4-[cyclopentyl(methyl)amino]-N-(3,5-difluorophenyl)piperidine-1-carbothioamide
Chemical Structure Depiction of
4-[cyclopentyl(methyl)amino]-N-(3,5-difluorophenyl)piperidine-1-carbothioamide
4-[cyclopentyl(methyl)amino]-N-(3,5-difluorophenyl)piperidine-1-carbothioamide
Compound characteristics
| Compound ID: | K788-6468 |
| Compound Name: | 4-[cyclopentyl(methyl)amino]-N-(3,5-difluorophenyl)piperidine-1-carbothioamide |
| Molecular Weight: | 353.48 |
| Molecular Formula: | C18 H25 F2 N3 S |
| Smiles: | CN(C1CCCC1)C1CCN(CC1)C(Nc1cc(cc(c1)F)F)=S |
| Stereo: | ACHIRAL |
| logP: | 4.6553 |
| logD: | 1.3294 |
| logSw: | -4.3877 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 13.1499 |
| InChI Key: | IHEARKBBVKMHAN-UHFFFAOYSA-N |