1-(4-chlorophenyl)-N-(4-cyanophenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Chemical Structure Depiction of
1-(4-chlorophenyl)-N-(4-cyanophenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
1-(4-chlorophenyl)-N-(4-cyanophenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | 8015-7993 |
| Compound Name: | 1-(4-chlorophenyl)-N-(4-cyanophenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide |
| Molecular Weight: | 417.85 |
| Molecular Formula: | C23 H16 Cl N3 O3 |
| Smiles: | C1CC2=C(C=C(C(Nc3ccc(C#N)cc3)=O)C(N2c2ccc(cc2)[Cl])=O)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1378 |
| logD: | 2.616 |
| logSw: | -3.8785 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.727 |
| InChI Key: | QQNVIUWWVNZJFH-UHFFFAOYSA-N |