N-[3-(azepan-1-yl)propyl]-3-[(4-methylphenyl)methanesulfonyl]propanamide
Chemical Structure Depiction of
N-[3-(azepan-1-yl)propyl]-3-[(4-methylphenyl)methanesulfonyl]propanamide
N-[3-(azepan-1-yl)propyl]-3-[(4-methylphenyl)methanesulfonyl]propanamide
Compound characteristics
| Compound ID: | K786-9223 |
| Compound Name: | N-[3-(azepan-1-yl)propyl]-3-[(4-methylphenyl)methanesulfonyl]propanamide |
| Molecular Weight: | 380.55 |
| Molecular Formula: | C20 H32 N2 O3 S |
| Smiles: | Cc1ccc(CS(CCC(NCCCN2CCCCCC2)=O)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.6155 |
| logD: | -1.0131 |
| logSw: | -2.4332 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.894 |
| InChI Key: | ZKHMFZPGIZCLKD-UHFFFAOYSA-N |