Category: iodides-buliding-blocks

Hu, Huiyong published the artcileDiscovery of 3,5-substituted 6-azaindazoles as potent pan-Pim inhibitors, SDS of cas: 1260665-99-3, the main research area is preparation azaindazole pan Pim inhibitor antitumor neoplasm; crystal structure; Fragment based screen; Kinase inhibitor; Lead optimization; Pim kinases; Screening; Structure based drug design.

Pim kinase inhibitors are promising cancer therapeutics. Pim-2, among the three Pim isoforms, plays a critical role in multiple myeloma yet inhibition of Pim-2 is challenging due to its high affinity for ATP. A cocrystal structure of a screening hit I bound to Pim-1 kinase revealed the key binding interactions of its indazole core within the ATP binding site. Screening of analogous core fragments afforded 1H-pyrazolo[3,4-c]pyridine (6-azaindazole) as a core for the development of pan-Pim inhibitors. Fragment and structure based drug design led to identification of the series with picomolar biochem. potency against all three Pim isoforms. Desirable cellular potency was also achieved.

Bioorganic & Medicinal Chemistry Letters published new progress about Antitumor agents. 1260665-99-3 belongs to class iodides-buliding-blocks, name is 3-Bromo-2-fluoro-6-iodopyridine, and the molecular formula is C5H2BrFIN, SDS of cas: 1260665-99-3.

Referemce:
Iodide – Wikipedia,
Iodide – an overview | ScienceDirect Topics – ScienceDirect.com

Medda, Federico published the artcileNovel Cambinol Analogs as Sirtuin Inhibitors: Synthesis, Biological Evaluation, and Rationalization of Activity, Safety of Ethyl 3-(4-iodophenyl)-3-oxopropanoate, the main research area is cambinol analog preparation sirtuin inhibitor antitumor structure.

The tenovins and cambinol are two classes of sirtuin inhibitor that exhibit antitumor activity in preclin. models. This report describes modifications to the core structure of cambinol, in particular by incorporation of substituents at the N1-position, which lead to increased potency and modified selectivity. These improvements have been rationalized using mol. modeling techniques. The expected functional selectivity in cells was also observed for both a SIRT1 and a SIRT2 selective analog.

Journal of Medicinal Chemistry published new progress about Antitumor agents. 63131-30-6 belongs to class iodides-buliding-blocks, name is Ethyl 3-(4-iodophenyl)-3-oxopropanoate, and the molecular formula is C11H11IO3, Safety of Ethyl 3-(4-iodophenyl)-3-oxopropanoate.

Referemce:
Iodide – Wikipedia,
Iodide – an overview | ScienceDirect Topics – ScienceDirect.com

Pan, Wen-Bin published the artcileNitrophenol derivatives obtained by oxidation with cerium(IV) ammonium nitrate (CAN) and their cytotoxicity, Safety of 4-Iodo-2-nitrophenol, the main research area is phenol derivative nitration cerium ammonium nitrate; nitrophenol derivative preparation antitumor; cerium ammonium nitrate nitration mediator.

Nitration of a series of phenols with cerium(IV) ammonium nitrate in acetonitrile under mild conditions yielded the mixture of corresponding nitrophenols. The prepared compounds have been tested for their antitumor activity on Hep G2, Hep 3B, MCF-7 and MDA-MB-231 cancer cell lines. Some of them showed selective activities.

Journal of the Chinese Chemical Society (Taipei, Taiwan) published new progress about Antitumor agents. 21784-73-6 belongs to class iodides-buliding-blocks, name is 4-Iodo-2-nitrophenol, and the molecular formula is C6H4INO3, Safety of 4-Iodo-2-nitrophenol.

Referemce:
Iodide – Wikipedia,
Iodide – an overview | ScienceDirect Topics – ScienceDirect.com

Foley, Daniel J. published the artcilePhenotyping Reveals Targets of a Pseudo-Natural-Product Autophagy Inhibitor, Formula: C5H4IN3O2, the main research area is indocinchona alkaloid synthesis palladium catalyzed annulation autophagy inhibitor; alkaloids; autophagy; chemical biology; inhibitors; natural products.

Pseudo-natural-product (NP) design combines natural product fragments to provide unprecedented NP-inspired compounds not accessible by biosynthesis, but endowed with biol. relevance. Since the bioactivity of pseudo-NPs may be unprecedented or unexpected, they are best evaluated in target agnostic cell-based assays monitoring entire cellular programs or complex phenotypes. Here, the Cinchona alkaloid scaffold was merged with the indole ring system to synthesize indocinchona alkaloids by Pd-catalyzed annulation. Exploration of indocinchona alkaloid bioactivities in phenotypic assays revealed a novel class of azaindole-containing autophagy inhibitors, the azaquindoles. Subsequent characterization of the most potent compound, azaquindole-1 (I), in the morphol. cell painting assay, guided target identification efforts. In contrast to the parent Cinchona alkaloids, azaquindoles selectively inhibit starvation- and rapamycin-induced autophagy by targeting the lipid kinase VPS34.

Angewandte Chemie, International Edition published new progress about Autophagy inhibitors. 25391-56-4 belongs to class iodides-buliding-blocks, name is 3-Iodo-5-nitropyridin-2-amine, and the molecular formula is C5H4IN3O2, Formula: C5H4IN3O2.

Referemce:
Iodide – Wikipedia,
Iodide – an overview | ScienceDirect Topics – ScienceDirect.com

Luccarelli, James published the artcileUnpicking the determinants of amide NH···O=C hydrogen bond strength with diphenylacetylene molecular balances, Related Products of iodides-buliding-blocks, the main research area is diphenylacetylene preparation hydrogen bond strength conformation substituent effect.

Hydrogen bonding plays an essential part in dictating the properties of natural and synthetic materials. Secondary amides are well suited to cross-strand interactions through the display of both hydrogen bond donors and acceptors and are prevalent in polymers such as proteins, nylon and Kevlar. In attempting to measure hydrogen bond strength and to delineate the stereoelectronic components of the interaction, context frequently becomes vitally important. This makes mol. balances – systems in which direct comparison of two groups is possible – an appealing bottom up approach that allows the complexity of larger systems to be stripped away. We have previously reported a family of single mol. conformational switches that are responsive to diverse stimuli including Bronsted and Lewis acids, anions and redox gradients. In this work we assess the ability of the scaffold, based on a 2,6-disubstituted diphenylacetylene, to measure accurately the difference in hydrogen bond strength between variously functionalized amides. In all of the examples investigated hydrogen bond strength closely correlate to measures of Bronsted acidity suggesting that the scaffold is well-suited as a platform for the accurate determination of bond strength in variously substituted systems.

Organic & Biomolecular Chemistry published new progress about Bond angle, dihedral. 105752-04-3 belongs to class iodides-buliding-blocks, name is 4-Iodo-3-nitroaniline, and the molecular formula is C6H5IN2O2, Related Products of iodides-buliding-blocks.

Referemce:
Iodide – Wikipedia,
Iodide – an overview | ScienceDirect Topics – ScienceDirect.com

Gould, J. P. published the artcileKinetics of the heterogeneous ozonation of nitrated phenols, Formula: C6H4INO3, the main research area is nitrophenol ozonization water wastewater.

The kinetics of the heterogeneous ozonization of PhOH and 27 nitrophenols representing a wide array of functional groups was studied. In the systems examined, the process was of zero order with respect to phenolic concentration, which indicates mass transfer as the prime control on the process. Anal. of the 1st-order rate constants permitted computation of overall mass transfer coefficients for all compounds The coefficients were 60% lower than the kLa (where kL = liquid mass transfer coefficient and a = sp. interfacial surface area) values measured by others in water and showed very little variation regardless of chem. structure of the phenol. Efforts at development of a QSAR model for the kinetics were fruitless.

Water Science and Technology published new progress about Ozonization kinetics. 21784-73-6 belongs to class iodides-buliding-blocks, name is 4-Iodo-2-nitrophenol, and the molecular formula is C6H4INO3, Formula: C6H4INO3.

Referemce:
Iodide – Wikipedia,
Iodide – an overview | ScienceDirect Topics – ScienceDirect.com

Ludwig, Jacob R. published the artcileIron(III)-catalysed carbonyl-olefin metathesis, COA of Formula: C11H11IO3, the main research area is cycloalkane preparation iron catalyzed carbonyl olefin metathesis.

The olefin metathesis reaction of two unsaturated substrates is one of the most powerful carbon-carbon-bond-forming reactions in organic chem. Specifically, the catalytic olefin metathesis reaction has led to profound developments in the synthesis of mols. relevant to the petroleum, materials, agricultural and pharmaceutical industries. These reactions are characterized by their use of discrete metal alkylidene catalysts that operate via a well-established mechanism. While the corresponding carbonyl-olefin metathesis reaction can also be used to construct carbon-carbon bonds, currently available methods are scarce and severely hampered by either harsh reaction conditions or the required use of stoichiometric transition metals as reagents. To date, no general protocol for catalytic carbonyl-olefin metathesis has been reported. Here we demonstrate a catalytic carbonyl-olefin ring-closing metathesis reaction that uses iron, an Earth-abundant and environmentally benign transition metal, as a catalyst. This transformation accommodates a variety of substrates and is distinguished by its operational simplicity, mild reaction conditions, high functional-group tolerance, and amenability to gram-scale synthesis. We anticipate that these characteristics, coupled with the efficiency of this reaction, will allow for further advances in areas that have historically been enhanced by olefin metathesis.

Nature (London, United Kingdom) published new progress about Activation enthalpy. 63131-30-6 belongs to class iodides-buliding-blocks, name is Ethyl 3-(4-iodophenyl)-3-oxopropanoate, and the molecular formula is C11H11IO3, COA of Formula: C11H11IO3.

Referemce:
Iodide – Wikipedia,
Iodide – an overview | ScienceDirect Topics – ScienceDirect.com

Christiansen, Elisabeth published the artcileIdentification of a Potent and Selective Free Fatty Acid Receptor 1 (FFA1/GPR40) Agonist with Favorable Physicochemical and in Vitro ADME Properties, Related Products of iodides-buliding-blocks, the main research area is FFA1 GPR40 receptor preparation structure ADME diabetes.

The free fatty acid receptor 1 (FFA1, also known as GPR40) enhances glucose-stimulated insulin secretion from pancreatic β-cells and is recognized as an interesting new target for treatment of type 2 diabetes. Several series of selective FFA1 agonists are already known. Most of these are derived from free fatty acids (FFAs) or glitazones and are relatively lipophilic. Aiming for the development of potent, selective, and less lipophilic FFA1 agonists, the terminal Ph of a known compound series was replaced by nitrogen containing heterocycles. This resulted in the identification of 37, a selective FFA1 agonist with potent activity on recombinant human FFA1 receptors and on the rat insulinoma cell line INS-1E, optimal lipophilicity, and excellent in vitro permeability and metabolic stability.

Journal of Medicinal Chemistry published new progress about Antidiabetic agents. 153034-78-7 belongs to class iodides-buliding-blocks, name is 2-Fluoro-3-iodo-5-methylpyridine, and the molecular formula is C6H5FIN, Related Products of iodides-buliding-blocks.

Referemce:
Iodide – Wikipedia,
Iodide – an overview | ScienceDirect Topics – ScienceDirect.com

Wu, Qiuyue published the artcileSulfur-controlled and rhodium-catalyzed formal (3 + 3) transannulation of thioacyl carbenes with alk-2-enals and mechanistic insights, Product Details of C11H11IO3, the main research area is dihydrothiopyranone preparation; thiadiazole alkenal preparation denitrogenative transannulation rhodium catalyst.

A rhodium-catalyzed denitrogenative formal (3+3) transannulation of 1,2,3-thiadiazoles I (Ar = Ph, 2H-1,3-benzodioxol-5-yl, furan-2-yl, etc.) with alk-2-enals R3C(R2)=C(R1)CHO [R1 = H, Me; R2 = H, Me, 4-methoxyphenyl, cyclohexyl, etc.; R3 = H, Me,4-methylpent-3-en-1-yl; R2R3 = -(CH2)4-, -(CH2)6-, -(CH2)12-, etc.] is achieved, producing 2,3-dihydrothiopyran-4-ones II in moderate to excellent yields. An inverse KIE of 0.49 is obtained, suggesting the reversibility of the oxidative addition of thioacyl Rh(I) carbenes to alk-2-enals. The late-stage structural modifications of steroid compounds III are realized. Moreover, this study shows that thioacyl carbenes have different reactivities to those of α-oxo and α-imino carbenes, and highlight the importance of heteroatoms in deciding the reactivities of heterovinyl carbenes.

Organic & Biomolecular Chemistry published new progress about Cyclization ((3+3)). 63131-30-6 belongs to class iodides-buliding-blocks, name is Ethyl 3-(4-iodophenyl)-3-oxopropanoate, and the molecular formula is C11H11IO3, Product Details of C11H11IO3.

Referemce:
Iodide – Wikipedia,
Iodide – an overview | ScienceDirect Topics – ScienceDirect.com

Ershad Halim, Md. published the artcileSynthesis of bromo- and iodo-substituted pyromellitic diimide-based [2+2]- and [3+3]macrocycles, and their absorption spectra and electrochemical and inclusion properties, Computed Properties of 2100-25-6, the main research area is pyromellitic diimide macrocycle absorption spectra electrochem inclusion.

New pyromellitic diimide-based tetrabromo[2+2]macrocycle ([2+2]MC) 2, tribromo- and hexabromo[3+3]MCs 3a and 3b, and triiodo[3+3]MC 3c were synthesized as structural units of covalently bound nanotubes, and their absorption spectra and redox properties, and inclusion phenomena of the [2+2]MC 2 were reported. Tetrabromo[2+2]MC 2 forms a 1:1 inclusion complex with toluene, whose structure was revealed by x-ray structural anal.

Tetrahedron Letters published new progress about Absorption spectra. 2100-25-6 belongs to class iodides-buliding-blocks, name is 3-Iodo-1,2,4,5-tetramethylbenzene, and the molecular formula is C10H13I, Computed Properties of 2100-25-6.

Referemce:
Iodide – Wikipedia,
Iodide – an overview | ScienceDirect Topics – ScienceDirect.com