N-[(3,4-dimethylphenyl)methyl]-4-(4-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxamide
Chemical Structure Depiction of
N-[(3,4-dimethylphenyl)methyl]-4-(4-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxamide
N-[(3,4-dimethylphenyl)methyl]-4-(4-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxamide
Compound characteristics
| Compound ID: | 4698-0822 |
| Compound Name: | N-[(3,4-dimethylphenyl)methyl]-4-(4-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxamide |
| Molecular Weight: | 453.54 |
| Molecular Formula: | C28 H27 N3 O3 |
| Smiles: | Cc1ccc(CNC(c2ccc3c(c2)C2C=CCC2C(c2ccc(cc2)[N+]([O-])=O)N3)=O)cc1C |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.4369 |
| logD: | 6.4369 |
| logSw: | -5.5887 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.116 |
| InChI Key: | DHHKXFZQQNWVNJ-UHFFFAOYSA-N |