4-[cycloheptyl(methyl)amino]-N-[3-(methylsulfanyl)phenyl]piperidine-1-carbothioamide
Chemical Structure Depiction of
4-[cycloheptyl(methyl)amino]-N-[3-(methylsulfanyl)phenyl]piperidine-1-carbothioamide
4-[cycloheptyl(methyl)amino]-N-[3-(methylsulfanyl)phenyl]piperidine-1-carbothioamide
Compound characteristics
| Compound ID: | K788-7334 |
| Compound Name: | 4-[cycloheptyl(methyl)amino]-N-[3-(methylsulfanyl)phenyl]piperidine-1-carbothioamide |
| Molecular Weight: | 391.64 |
| Molecular Formula: | C21 H33 N3 S2 |
| Smiles: | CN(C1CCCCCC1)C1CCN(CC1)C(Nc1cccc(c1)SC)=S |
| Stereo: | ACHIRAL |
| logP: | 5.6409 |
| logD: | 2.7938 |
| logSw: | -5.4846 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 13.115 |
| InChI Key: | UCUDIRVGYMEUFS-UHFFFAOYSA-N |