2-chloro-N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]-4-nitrobenzamide
Chemical Structure Depiction of
2-chloro-N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]-4-nitrobenzamide
2-chloro-N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]-4-nitrobenzamide
Compound characteristics
| Compound ID: | C095-0294 |
| Compound Name: | 2-chloro-N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]-4-nitrobenzamide |
| Molecular Weight: | 453.93 |
| Molecular Formula: | C23 H24 Cl N5 O3 |
| Smiles: | CCN1CCN(CC1)c1cc(C)c2cc(ccc2n1)NC(c1ccc(cc1[Cl])[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.128 |
| logD: | 4.4405 |
| logSw: | -5.5325 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.495 |
| InChI Key: | OALBVUKKQBMOFN-UHFFFAOYSA-N |