938002-48-3
ETHYL [6-CYCLOPROPYL-3-METHYL-4-(TRIFLUOROMETHYL)-1H-PYRAZOLO[3,4-B]PYRIDIN-1-YL]ACETATE
NameETHYL [6-CYCLOPROPYL-3-METHYL-4-(TRIFLUOROMETHYL)-1H-PYRAZOLO[3,4-B]PYRIDIN-1-YL]ACETATE
pro_formulaC15 H16 F3 N3 O2
1Identification
【Name】
ETHYL [6-CYCLOPROPYL-3-METHYL-4-(TRIFLUOROMETHYL)-1H-PYRAZOLO[3,4-B]PYRIDIN-1-YL]ACETATE
【CAS】
【MDL】
MFCD08558958
【EnglishSynonyms】
【pro_formula】
C15 H16 F3 N3 O2
【pro_molWeight】
327.304
【Inchi】
InChI=1S/C15H16F3N3O2/c1-3-23-12(22)7-21-14-13(8(2)20-21)10(15(16,17)18)6-11(19-14)9-4-5-9/h6,9H,3-5,7H2,1-2H3
【InChIKey】
InChIKey=AAGGUIXYEFWSAJ-UHFFFAOYSA-N
【SMILES】
CCOC(=O)Cn1c2c(c(n1)C)c(cc(n2)C3CC3)C(F)(F)F
【MOL File】
ETHYL [6-CYCLOPROPYL….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:5
XLogP3:3.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
ETHYL [6-CYCLOPROPYL-3-METHYL-4-(TRIFLUOROMETHYL)-1H-PYRAZOLO[3,4-B]PYRIDIN-1-YL]ACETATE.cml