4-[butyl(methyl)amino]-N-(3-chloro-4-fluorophenyl)piperidine-1-carbothioamide
Chemical Structure Depiction of
4-[butyl(methyl)amino]-N-(3-chloro-4-fluorophenyl)piperidine-1-carbothioamide
4-[butyl(methyl)amino]-N-(3-chloro-4-fluorophenyl)piperidine-1-carbothioamide
Compound characteristics
| Compound ID: | K788-7608 |
| Compound Name: | 4-[butyl(methyl)amino]-N-(3-chloro-4-fluorophenyl)piperidine-1-carbothioamide |
| Molecular Weight: | 357.92 |
| Molecular Formula: | C17 H25 Cl F N3 S |
| Smiles: | CCCCN(C)C1CCN(CC1)C(Nc1ccc(c(c1)[Cl])F)=S |
| Stereo: | ACHIRAL |
| logP: | 4.6735 |
| logD: | 1.5877 |
| logSw: | -4.9654 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 13.9822 |
| InChI Key: | DGSKHLINSOZAJX-UHFFFAOYSA-N |