1-[(2-methylphenyl)methanesulfonyl]-N-{2-[(4-methylphenyl)sulfanyl]ethyl}piperidine-4-carboxamide
Chemical Structure Depiction of
1-[(2-methylphenyl)methanesulfonyl]-N-{2-[(4-methylphenyl)sulfanyl]ethyl}piperidine-4-carboxamide
1-[(2-methylphenyl)methanesulfonyl]-N-{2-[(4-methylphenyl)sulfanyl]ethyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | D356-0536 |
| Compound Name: | 1-[(2-methylphenyl)methanesulfonyl]-N-{2-[(4-methylphenyl)sulfanyl]ethyl}piperidine-4-carboxamide |
| Molecular Weight: | 446.63 |
| Molecular Formula: | C23 H30 N2 O3 S2 |
| Smiles: | Cc1ccc(cc1)SCCNC(C1CCN(CC1)S(Cc1ccccc1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.192 |
| logD: | 4.192 |
| logSw: | -4.0136 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.098 |
| InChI Key: | BNDBLWMMSKSKRU-UHFFFAOYSA-N |