ethyl 3-{[1-(3-chlorophenyl)-7,7-dimethyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonyl]amino}-3-(4-methylphenyl)propanoate
Chemical Structure Depiction of
ethyl 3-{[1-(3-chlorophenyl)-7,7-dimethyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonyl]amino}-3-(4-methylphenyl)propanoate
ethyl 3-{[1-(3-chlorophenyl)-7,7-dimethyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonyl]amino}-3-(4-methylphenyl)propanoate
Compound characteristics
| Compound ID: | 8017-5331 |
| Compound Name: | ethyl 3-{[1-(3-chlorophenyl)-7,7-dimethyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonyl]amino}-3-(4-methylphenyl)propanoate |
| Molecular Weight: | 535.04 |
| Molecular Formula: | C30 H31 Cl N2 O5 |
| Smiles: | CCOC(CC(c1ccc(C)cc1)NC(C1=CC2=C(CC(C)(C)CC2=O)N(C1=O)c1cccc(c1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0058 |
| logD: | 5.0034 |
| logSw: | -5.2331 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.782 |
| InChI Key: | SJSJDRPNTSXOPE-DEOSSOPVSA-N |