N-[2-(methylsulfanyl)phenyl]-1-(phenylmethanesulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[2-(methylsulfanyl)phenyl]-1-(phenylmethanesulfonyl)piperidine-4-carboxamide
N-[2-(methylsulfanyl)phenyl]-1-(phenylmethanesulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | D356-0414 |
| Compound Name: | N-[2-(methylsulfanyl)phenyl]-1-(phenylmethanesulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 404.55 |
| Molecular Formula: | C20 H24 N2 O3 S2 |
| Smiles: | CSc1ccccc1NC(C1CCN(CC1)S(Cc1ccccc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6998 |
| logD: | 2.6998 |
| logSw: | -3.1137 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.237 |
| InChI Key: | IZAOOUVGURRLFA-UHFFFAOYSA-N |