N-{2-[(4-methylphenyl)sulfanyl]ethyl}-1-(phenylmethanesulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-{2-[(4-methylphenyl)sulfanyl]ethyl}-1-(phenylmethanesulfonyl)piperidine-4-carboxamide
N-{2-[(4-methylphenyl)sulfanyl]ethyl}-1-(phenylmethanesulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | D356-0305 |
| Compound Name: | N-{2-[(4-methylphenyl)sulfanyl]ethyl}-1-(phenylmethanesulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 432.6 |
| Molecular Formula: | C22 H28 N2 O3 S2 |
| Smiles: | Cc1ccc(cc1)SCCNC(C1CCN(CC1)S(Cc1ccccc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1924 |
| logD: | 3.1924 |
| logSw: | -3.2942 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.098 |
| InChI Key: | PUOUMFKRFBOGGA-UHFFFAOYSA-N |