2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]-N-(3,4-dimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]-N-(3,4-dimethoxyphenyl)acetamide
2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]-N-(3,4-dimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | K906-2895 |
| Compound Name: | 2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]-N-(3,4-dimethoxyphenyl)acetamide |
| Molecular Weight: | 489.55 |
| Molecular Formula: | C23 H27 N3 O7 S |
| Smiles: | COc1ccc(cc1OC)NC(CN1C(=O)Oc2cc(ccc12)S(N1CCCCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8611 |
| logD: | 2.861 |
| logSw: | -3.5705 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.519 |
| InChI Key: | OKRUDLKQEAXVRK-UHFFFAOYSA-N |