4-(2,3-dimethylphenyl)-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]piperazine-1-carbothioamide
Chemical Structure Depiction of
4-(2,3-dimethylphenyl)-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]piperazine-1-carbothioamide
4-(2,3-dimethylphenyl)-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]piperazine-1-carbothioamide
Compound characteristics
| Compound ID: | C267-0411 |
| Compound Name: | 4-(2,3-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: | Cc1cccc(c1C)N1CCN(CC1)C(Nc1ccc2c(c1)c(C)cc(n2)N1CCN(C)CC1)=S |
| Stereo: | ACHIRAL |
| logP: | 6.2713 |
| logD: | 5.7014 |
| logSw: | -5.8186 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.8194 |
| InChI Key: | WXEINBUODAZFBY-UHFFFAOYSA-N |