N-[4-(azepane-1-sulfonyl)phenyl]-2-[(2-methoxyethyl)sulfanyl]benzamide
Chemical Structure Depiction of
N-[4-(azepane-1-sulfonyl)phenyl]-2-[(2-methoxyethyl)sulfanyl]benzamide
N-[4-(azepane-1-sulfonyl)phenyl]-2-[(2-methoxyethyl)sulfanyl]benzamide
Compound characteristics
| Compound ID: | Y031-0251 |
| Compound Name: | N-[4-(azepane-1-sulfonyl)phenyl]-2-[(2-methoxyethyl)sulfanyl]benzamide |
| Molecular Weight: | 448.6 |
| Molecular Formula: | C22 H28 N2 O4 S2 |
| Smiles: | COCCSc1ccccc1C(Nc1ccc(cc1)S(N1CCCCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7045 |
| logD: | 3.6689 |
| logSw: | -3.8833 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.714 |
| InChI Key: | WAQYCBOHPWCKLC-UHFFFAOYSA-N |