1-(3-chlorophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-7,7-dimethyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Chemical Structure Depiction of
1-(3-chlorophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-7,7-dimethyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
1-(3-chlorophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-7,7-dimethyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | 8017-1949 |
| Compound Name: | 1-(3-chlorophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-7,7-dimethyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide |
| Molecular Weight: | 509 |
| Molecular Formula: | C28 H29 Cl N2 O5 |
| Smiles: | CC1(C)CC2=C(C=C(C(NCCc3ccc(c(c3)OC)OC)=O)C(N2c2cccc(c2)[Cl])=O)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.173 |
| logD: | 3.1729 |
| logSw: | -3.5594 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.095 |
| InChI Key: | IPHFGNXWNDNHGL-UHFFFAOYSA-N |