N-(2-ethylphenyl)-4-[methyl(3-methylbutyl)amino]piperidine-1-carbothioamide
Chemical Structure Depiction of
N-(2-ethylphenyl)-4-[methyl(3-methylbutyl)amino]piperidine-1-carbothioamide
N-(2-ethylphenyl)-4-[methyl(3-methylbutyl)amino]piperidine-1-carbothioamide
Compound characteristics
| Compound ID: | K786-3578 |
| Compound Name: | N-(2-ethylphenyl)-4-[methyl(3-methylbutyl)amino]piperidine-1-carbothioamide |
| Molecular Weight: | 347.57 |
| Molecular Formula: | C20 H33 N3 S |
| Smiles: | CCc1ccccc1NC(N1CCC(CC1)N(C)CCC(C)C)=S |
| Stereo: | ACHIRAL |
| logP: | 5.1984 |
| logD: | 2.1597 |
| logSw: | -5.0696 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 13.2844 |
| InChI Key: | LOTDSXYZZUQWDX-UHFFFAOYSA-N |