3-acetamido-N-[3-(azepan-1-yl)propyl]-4-[(4-methylphenyl)sulfanyl]benzamide
Chemical Structure Depiction of
3-acetamido-N-[3-(azepan-1-yl)propyl]-4-[(4-methylphenyl)sulfanyl]benzamide
3-acetamido-N-[3-(azepan-1-yl)propyl]-4-[(4-methylphenyl)sulfanyl]benzamide
Compound characteristics
| Compound ID: | K786-2184 |
| Compound Name: | 3-acetamido-N-[3-(azepan-1-yl)propyl]-4-[(4-methylphenyl)sulfanyl]benzamide |
| Molecular Weight: | 439.62 |
| Molecular Formula: | C25 H33 N3 O2 S |
| Smiles: | CC(Nc1cc(ccc1Sc1ccc(C)cc1)C(NCCCN1CCCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2227 |
| logD: | 1.652 |
| logSw: | -3.9491 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.099 |
| InChI Key: | YUDCCYLJEGIOAS-UHFFFAOYSA-N |