N-(3-chloro-2-methylphenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide
N-(3-chloro-2-methylphenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide
Compound characteristics
| Compound ID: | Y600-1180 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide |
| Molecular Weight: | 298.83 |
| Molecular Formula: | C14 H19 Cl N2 O S |
| Smiles: | Cc1c(cccc1[Cl])NC(N1CCCC(C1)CO)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6629 |
| logD: | 3.6629 |
| logSw: | -3.6927 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 27.4875 |
| InChI Key: | RPTXBGIKZFUUEF-NSHDSACASA-N |