4-(4-ethylphenyl)-3-(4-nitrophenyl)-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Chemical Structure Depiction of
4-(4-ethylphenyl)-3-(4-nitrophenyl)-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
4-(4-ethylphenyl)-3-(4-nitrophenyl)-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Compound characteristics
| Compound ID: | C202-1878 |
| Compound Name: | 4-(4-ethylphenyl)-3-(4-nitrophenyl)-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one |
| Molecular Weight: | 414.46 |
| Molecular Formula: | C24 H22 N4 O3 |
| Smiles: | CCc1ccc(cc1)C1C2=C(CCCC2=O)Nc2c1c(c1ccc(cc1)[N+]([O-])=O)n[nH]2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.829 |
| logD: | 4.8283 |
| logSw: | -4.6847 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.487 |
| InChI Key: | BBXKPSNDZXAGDA-FQEVSTJZSA-N |