N-(3,5-dimethylphenyl)-4-[methyl(3-methylbutyl)amino]piperidine-1-carbothioamide
Chemical Structure Depiction of
N-(3,5-dimethylphenyl)-4-[methyl(3-methylbutyl)amino]piperidine-1-carbothioamide
N-(3,5-dimethylphenyl)-4-[methyl(3-methylbutyl)amino]piperidine-1-carbothioamide
Compound characteristics
| Compound ID: | K786-3579 |
| Compound Name: | N-(3,5-dimethylphenyl)-4-[methyl(3-methylbutyl)amino]piperidine-1-carbothioamide |
| Molecular Weight: | 347.57 |
| Molecular Formula: | C20 H33 N3 S |
| Smiles: | CC(C)CCN(C)C1CCN(CC1)C(Nc1cc(C)cc(C)c1)=S |
| Stereo: | ACHIRAL |
| logP: | 5.0482 |
| logD: | 2.0094 |
| logSw: | -4.612 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 13.9822 |
| InChI Key: | QXEJFMZLWSMWTB-UHFFFAOYSA-N |