N-(2-chloro-4-methylphenyl)-4-[cycloheptyl(methyl)amino]piperidine-1-carbothioamide
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-4-[cycloheptyl(methyl)amino]piperidine-1-carbothioamide
N-(2-chloro-4-methylphenyl)-4-[cycloheptyl(methyl)amino]piperidine-1-carbothioamide
Compound characteristics
| Compound ID: | K788-7335 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-4-[cycloheptyl(methyl)amino]piperidine-1-carbothioamide |
| Molecular Weight: | 394.02 |
| Molecular Formula: | C21 H32 Cl N3 S |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(N1CCC(CC1)N(C)C1CCCCCC1)=S |
| Stereo: | ACHIRAL |
| logP: | 6.2474 |
| logD: | 3.4004 |
| logSw: | -6.2094 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 12.4171 |
| InChI Key: | PRSWENIDGZEBMK-UHFFFAOYSA-N |