4-(3,4-dihydroxyphenyl)-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-(3,4-dihydroxyphenyl)-3,7,7-trimethyl-1-phenyl-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
4-(3,4-dihydroxyphenyl)-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: | C202-3729 |
| Compound Name: | 4-(3,4-dihydroxyphenyl)-3,7,7-trimethyl-1-phenyl-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one |
| Molecular Weight: | 415.49 |
| Molecular Formula: | C25 H25 N3 O3 |
| Smiles: | Cc1c2C(C3=C(CC(C)(C)CC3=O)Nc2n(c2ccccc2)n1)c1ccc(c(c1)O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.516 |
| logD: | 3.3972 |
| logSw: | -3.4893 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 71.67 |
| InChI Key: | VNKYOYCOXWAGKE-JOCHJYFZSA-N |