CAS 1173047-60-3

Ethyl 3-cyclopropyl-6-(1-methyl-1H-pyrazol-3-yl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine-1-acetate

Description:

Ethyl 3-cyclopropyl-6-(1-methyl-1H-pyrazol-3-yl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine-1-acetate, identified by its CAS number 1173047-60-3, is a complex organic compound characterized by its unique structural features, including a pyrazolo[3,4-b]pyridine core, which is a bicyclic structure known for its biological activity. The presence of a trifluoromethyl group enhances its lipophilicity and may influence its pharmacological properties. The ethyl acetate moiety suggests potential solubility in organic solvents, making it suitable for various applications in medicinal chemistry. Additionally, the cyclopropyl group can impart strain and reactivity, potentially affecting the compound's interaction with biological targets. The incorporation of pyrazole rings indicates possible activity in areas such as anti-inflammatory or anti-cancer research. Overall, this compound's intricate structure and functional groups suggest it may exhibit significant biological activity, warranting further investigation in pharmaceutical applications.

Formula: C₁₈H₁₈F₃N₅O₂

InChI: InChI=1S/C18H18F3N5O2/c1-3-28-14(27)9-26-17-15(16(24-26)10-4-5-10)11(18(19,20)21)8-13(22-17)12-6-7-25(2)23-12/h6-8,10H,3-5,9H2,1-2H3

InChI key: InChIKey=SCXLWHCTZZTOFS-UHFFFAOYSA-N

SMILES: C(F)(F)(F)C1=C2C(N(CC(OCC)=O)N=C2C3CC3)=NC(=C1)C4=NN(C)C=C4

Synonyms:

• 1H-Pyrazolo[3,4-b]pyridine-1-acetic acid, 3-cyclopropyl-6-(1-methyl-1H-pyrazol-3-yl)-4-(trifluoromethyl)-, ethyl ester
• Ethyl 3-cyclopropyl-6-(1-methyl-1H-pyrazol-3-yl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine-1-acetate