1-[(4-methylphenyl)methanesulfonyl]-N-[2-(methylsulfanyl)phenyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-[(4-methylphenyl)methanesulfonyl]-N-[2-(methylsulfanyl)phenyl]piperidine-4-carboxamide
1-[(4-methylphenyl)methanesulfonyl]-N-[2-(methylsulfanyl)phenyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | D356-1077 |
| Compound Name: | 1-[(4-methylphenyl)methanesulfonyl]-N-[2-(methylsulfanyl)phenyl]piperidine-4-carboxamide |
| Molecular Weight: | 418.58 |
| Molecular Formula: | C21 H26 N2 O3 S2 |
| Smiles: | Cc1ccc(CS(N2CCC(CC2)C(Nc2ccccc2SC)=O)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1232 |
| logD: | 3.1232 |
| logSw: | -3.2287 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.237 |
| InChI Key: | VMQCRUVIBRWUNP-UHFFFAOYSA-N |