3-hydroxy-7,7-dimethyl-2-phenyl-4-(thiophen-2-yl)-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-(thiophen-2-yl)-2,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
3-hydroxy-7,7-dimethyl-2-phenyl-4-(thiophen-2-yl)-2,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Compound characteristics
| Compound ID: | 8015-4239 |
| Compound Name: | 3-hydroxy-7,7-dimethyl-2-phenyl-4-(thiophen-2-yl)-2,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one |
| Molecular Weight: | 391.49 |
| Molecular Formula: | C22 H21 N3 O2 S |
| Smiles: | CC1(C)CC2=C(C(c3c(N2)nn(c2ccccc2)c3O)c2cccs2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.767 |
| logD: | 2.996 |
| logSw: | -3.9633 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.137 |
| InChI Key: | AXBQBMFIYICWMU-GOSISDBHSA-N |