N-[2-(3,5-dimethylpiperidin-1-yl)-4-methylquinolin-6-yl]-4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxobutanamide
Chemical Structure Depiction of
N-[2-(3,5-dimethylpiperidin-1-yl)-4-methylquinolin-6-yl]-4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxobutanamide
N-[2-(3,5-dimethylpiperidin-1-yl)-4-methylquinolin-6-yl]-4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxobutanamide
Compound characteristics
| Compound ID: | C237-0222 |
| Compound Name: | N-[2-(3,5-dimethylpiperidin-1-yl)-4-methylquinolin-6-yl]-4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxobutanamide |
| Molecular Weight: | 558.68 |
| Molecular Formula: | C31 H38 N6 O4 |
| Smiles: | CC1CC(C)CN(C1)c1cc(C)c2cc(ccc2n1)NC(CCC(N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.4625 |
| logD: | 5.4623 |
| logSw: | -5.4868 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.264 |
| InChI Key: | KEEDHOGIZXGPTC-UHFFFAOYSA-N |