4-(2,5-dimethoxyphenyl)-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-(2,5-dimethoxyphenyl)-3,7,7-trimethyl-1-phenyl-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
4-(2,5-dimethoxyphenyl)-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: | C202-3801 |
| Compound Name: | 4-(2,5-dimethoxyphenyl)-3,7,7-trimethyl-1-phenyl-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one |
| Molecular Weight: | 443.55 |
| Molecular Formula: | C27 H29 N3 O3 |
| Smiles: | Cc1c2C(C3=C(CC(C)(C)CC3=O)Nc2n(c2ccccc2)n1)c1cc(ccc1OC)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8221 |
| logD: | 4.7033 |
| logSw: | -4.6952 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.748 |
| InChI Key: | JBVMGXHEZSZBEG-XMMPIXPASA-N |