4-[cyclohexyl(methyl)amino]-N-(2,5-dimethylphenyl)piperidine-1-carbothioamide
Chemical Structure Depiction of
4-[cyclohexyl(methyl)amino]-N-(2,5-dimethylphenyl)piperidine-1-carbothioamide
4-[cyclohexyl(methyl)amino]-N-(2,5-dimethylphenyl)piperidine-1-carbothioamide
Compound characteristics
| Compound ID: | K786-0108 |
| Compound Name: | 4-[cyclohexyl(methyl)amino]-N-(2,5-dimethylphenyl)piperidine-1-carbothioamide |
| Molecular Weight: | 359.58 |
| Molecular Formula: | C21 H33 N3 S |
| Smiles: | Cc1ccc(C)c(c1)NC(N1CCC(CC1)N(C)C1CCCCC1)=S |
| Stereo: | ACHIRAL |
| logP: | 5.0689 |
| logD: | 1.9974 |
| logSw: | -4.5638 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 12.0861 |
| InChI Key: | BTGCMUPZDQJSAS-UHFFFAOYSA-N |