CAS 862505-00-8

5-[2-(1,1-Dimethylethyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl]-3-(2,2-dimethylpropyl)-3H-imidazo[4,5-b]pyridin-2-amine

Description:

The chemical substance known as 5-[2-(1,1-Dimethylethyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl]-3-(2,2-dimethylpropyl)-3H-imidazo[4,5-b]pyridin-2-amine, with the CAS number 862505-00-8, is a complex organic compound characterized by its multi-ring structure, which includes imidazole and pyridine moieties. This compound features various functional groups, including an amine and a fluorophenyl substituent, contributing to its potential biological activity. It is typically synthesized through multi-step organic reactions, and its structure suggests possible interactions with biological targets, making it of interest in medicinal chemistry. The presence of bulky substituents, such as the tert-butyl and dimethylpropyl groups, may influence its solubility and permeability, which are critical for pharmacokinetic properties. Additionally, the fluorine atom may enhance the compound's metabolic stability and binding affinity. Overall, this compound's unique structural features position it as a candidate for further investigation in drug development and therapeutic applications.

Formula: C₂₄H₂₉FN₆

InChI: InChI=1S/C24H29FN6/c1-23(2,3)13-31-20-17(28-22(31)26)12-11-16(27-20)19-18(14-7-9-15(25)10-8-14)29-21(30-19)24(4,5)6/h7-12H,13H2,1-6H3,(H2,26,28)(H,29,30)

InChI key: InChIKey=XPPBBJCBDOEXDN-UHFFFAOYSA-N

SMILES: C(C)(C)(C)C=1NC(=C(N1)C2=CC=C(F)C=C2)C=3N=C4N(CC(C)(C)C)C(N)=NC4=CC3

Synonyms:

• LY 22288220
• 5-[2-(1,1-Dimethylethyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl]-3-(2,2-dimethylpropyl)-3H-imidazo[4,5-b]pyridin-2-amine
• 3H-Imidazo[4,5-b]pyridin-2-amine, 5-[2-(1,1-dimethylethyl)-5-(4-fluorophenyl)-1H-imidazol-4-yl]-3-(2,2-dimethylpropyl)-
• 3H-Imidazo[4,5-b]pyridin-2-amine, 5-[2-(1,1-dimethylethyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl]-3-(2,2-dimethylpropyl)-
• LY 2228820

Ralimetinib

CAS: 862505-00-8

Ralimetinib blocks MK2 phosphorylation at Thr334 without affecting p38α MAPK or JNK. It is an ATP-competitive inhibitor of p38 MAPK α/β (IC50 5.3/3.2 nM).

Formula: C₂₄H₂₉FN₆

Purity: 99.16% - 99.21%

Color and Shape: Solid

Molecular weight: 420.53

Ref: TM-T16721