N-[2-(azepane-1-carbonyl)phenyl]-1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-[2-(azepane-1-carbonyl)phenyl]-1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carboxamide
N-[2-(azepane-1-carbonyl)phenyl]-1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | D356-0662 |
| Compound Name: | N-[2-(azepane-1-carbonyl)phenyl]-1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carboxamide |
| Molecular Weight: | 497.66 |
| Molecular Formula: | C27 H35 N3 O4 S |
| Smiles: | Cc1ccccc1CS(N1CCC(CC1)C(Nc1ccccc1C(N1CCCCCC1)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.136 |
| logD: | 4.1286 |
| logSw: | -4.0811 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.216 |
| InChI Key: | YGIYAXLQMZIYJF-UHFFFAOYSA-N |