4-(2,5-dimethylphenyl)-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]piperazine-1-carbothioamide
Chemical Structure Depiction of
4-(2,5-dimethylphenyl)-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]piperazine-1-carbothioamide
4-(2,5-dimethylphenyl)-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]piperazine-1-carbothioamide
Compound characteristics
| Compound ID: | C267-0414 |
| Compound Name: | 4-(2,5-dimethylphenyl)-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]piperazine-1-carbothioamide |
| Molecular Weight: | 488.7 |
| Molecular Formula: | C28 H36 N6 S |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C(Nc1ccc2c(c1)c(C)cc(n2)N1CCN(C)CC1)=S |
| Stereo: | ACHIRAL |
| logP: | 6.3057 |
| logD: | 5.7357 |
| logSw: | -5.6563 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.8194 |
| InChI Key: | XKGYMEZDXUIVFP-UHFFFAOYSA-N |