937606-02-5
[3,6-DICYCLOPROPYL-4-(TRIFLUOROMETHYL)-1H-PYRAZOLO[3,4-B]PYRIDIN-1-YL]ACETIC ACID
Name[3,6-DICYCLOPROPYL-4-(TRIFLUOROMETHYL)-1H-PYRAZOLO[3,4-B]PYRIDIN-1-YL]ACETIC ACID
pro_formulaC15 H14 F3 N3 O2
1Identification
【Name】
[3,6-DICYCLOPROPYL-4-(TRIFLUOROMETHYL)-1H-PYRAZOLO[3,4-B]PYRIDIN-1-YL]ACETIC ACID
【CAS】
【MDL】
MFCD08697663
【EnglishSynonyms】
【pro_formula】
C15 H14 F3 N3 O2
【pro_molWeight】
325.289
【Inchi】
InChI=1S/C15H14F3N3O2/c16-15(17,18)9-5-10(7-1-2-7)19-14-12(9)13(8-3-4-8)20-21(14)6-11(22)23/h5,7-8H,1-4,6H2,(H,22,23)
【InChIKey】
InChIKey=AFCQVXHNERZCGZ-UHFFFAOYSA-N
【SMILES】
c1c(c2c(nn(c2nc1C3CC3)CC(=O)O)C4CC4)C(F)(F)F
【MOL File】
[3,6-DICYCLOPROPYL-4….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:5
XLogP3:2.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
[3,6-DICYCLOPROPYL-4-(TRIFLUOROMETHYL)-1H-PYRAZOLO[3,4-B]PYRIDIN-1-YL]ACETIC ACID.cml