3-hydroxy-7,7-dimethyl-2-phenyl-4-[4-(trifluoromethyl)phenyl]-2,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Chemical Structure Depiction of
3-hydroxy-7,7-dimethyl-2-phenyl-4-[4-(trifluoromethyl)phenyl]-2,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
3-hydroxy-7,7-dimethyl-2-phenyl-4-[4-(trifluoromethyl)phenyl]-2,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Compound characteristics
| Compound ID: | 6882-0478 |
| Compound Name: | 3-hydroxy-7,7-dimethyl-2-phenyl-4-[4-(trifluoromethyl)phenyl]-2,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one |
| Molecular Weight: | 453.46 |
| Molecular Formula: | C25 H22 F3 N3 O2 |
| Smiles: | CC1(C)CC2=C(C(c3ccc(cc3)C(F)(F)F)c3c(N2)nn(c2ccccc2)c3O)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9441 |
| logD: | 4.2001 |
| logSw: | -4.5511 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.118 |
| InChI Key: | WVNJZYYRAQNACD-IBGZPJMESA-N |