1-(4-chlorophenyl)-7,7-dimethyl-N-(3-nitrophenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Chemical Structure Depiction of
1-(4-chlorophenyl)-7,7-dimethyl-N-(3-nitrophenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
1-(4-chlorophenyl)-7,7-dimethyl-N-(3-nitrophenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | 5773-0054 |
| Compound Name: | 1-(4-chlorophenyl)-7,7-dimethyl-N-(3-nitrophenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide |
| Molecular Weight: | 465.89 |
| Molecular Formula: | C24 H20 Cl N3 O5 |
| Smiles: | CC1(C)CC2=C(C=C(C(Nc3cccc(c3)[N+]([O-])=O)=O)C(N2c2ccc(cc2)[Cl])=O)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1761 |
| logD: | 3.3559 |
| logSw: | -4.6151 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.053 |
| InChI Key: | LFXXBJRWVGCUMI-UHFFFAOYSA-N |