4-(2,5-dimethylphenyl)-N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]piperazine-1-carbothioamide
Chemical Structure Depiction of
4-(2,5-dimethylphenyl)-N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]piperazine-1-carbothioamide
4-(2,5-dimethylphenyl)-N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]piperazine-1-carbothioamide
Compound characteristics
| Compound ID: | C267-0178 |
| Compound Name: | 4-(2,5-dimethylphenyl)-N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]piperazine-1-carbothioamide |
| Molecular Weight: | 502.73 |
| Molecular Formula: | C29 H38 N6 S |
| Smiles: | CCN1CCN(CC1)c1cc(C)c2cc(ccc2n1)NC(N1CCN(CC1)c1cc(C)ccc1C)=S |
| Stereo: | ACHIRAL |
| logP: | 6.6504 |
| logD: | 5.963 |
| logSw: | -5.8162 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.8795 |
| InChI Key: | JFSMFEOBPCOVOJ-UHFFFAOYSA-N |