N-(4-chloro-2-methylphenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide
Chemical Structure Depiction of
N-(4-chloro-2-methylphenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide
N-(4-chloro-2-methylphenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide
Compound characteristics
Compound ID: | Y600-1181 |
Compound Name: | N-(4-chloro-2-methylphenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide |
Molecular Weight: | 298.83 |
Molecular Formula: | C14 H19 Cl N2 O S |
Smiles: | Cc1cc(ccc1NC(N1CCCC(C1)CO)=S)[Cl] |
Stereo: | RACEMIC MIXTURE |
logP: | 3.7163 |
logD: | 3.7163 |
logSw: | -3.9407 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 27.4875 |
InChI Key: | PNJDINKCYQQNSZ-NSHDSACASA-N |