4-[cycloheptyl(methyl)amino]-N-(2,3-dimethylphenyl)piperidine-1-carbothioamide
Chemical Structure Depiction of
4-[cycloheptyl(methyl)amino]-N-(2,3-dimethylphenyl)piperidine-1-carbothioamide
4-[cycloheptyl(methyl)amino]-N-(2,3-dimethylphenyl)piperidine-1-carbothioamide
Compound characteristics
| Compound ID: | K788-7333 |
| Compound Name: | 4-[cycloheptyl(methyl)amino]-N-(2,3-dimethylphenyl)piperidine-1-carbothioamide |
| Molecular Weight: | 373.6 |
| Molecular Formula: | C22 H35 N3 S |
| Smiles: | Cc1cccc(c1C)NC(N1CCC(CC1)N(C)C1CCCCCC1)=S |
| Stereo: | ACHIRAL |
| logP: | 6.1541 |
| logD: | 3.3071 |
| logSw: | -5.5938 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 12.4171 |
| InChI Key: | SHINPGAXVXKLRT-UHFFFAOYSA-N |