4-(3-chlorophenyl)-3,7,7-trimethyl-1-phenyl-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Chemical Structure Depiction of
4-(3-chlorophenyl)-3,7,7-trimethyl-1-phenyl-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
4-(3-chlorophenyl)-3,7,7-trimethyl-1-phenyl-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Compound characteristics
| Compound ID: | C202-4038 |
| Compound Name: | 4-(3-chlorophenyl)-3,7,7-trimethyl-1-phenyl-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one |
| Molecular Weight: | 417.94 |
| Molecular Formula: | C25 H24 Cl N3 O |
| Smiles: | Cc1c2C(C3=C(CC(C)(C)CC3=O)Nc2n(c2ccccc2)n1)c1cccc(c1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1654 |
| logD: | 5.0466 |
| logSw: | -5.5649 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.573 |
| InChI Key: | MBYBDOHBSVXDEL-JOCHJYFZSA-N |