2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]-N-(3,4-dimethylphenyl)acetamide
Chemical Structure Depiction of
2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]-N-(3,4-dimethylphenyl)acetamide
2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]-N-(3,4-dimethylphenyl)acetamide
Compound characteristics
| Compound ID: | C989-0328 |
| Compound Name: | 2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]-N-(3,4-dimethylphenyl)acetamide |
| Molecular Weight: | 457.55 |
| Molecular Formula: | C23 H27 N3 O5 S |
| Smiles: | Cc1ccc(cc1C)NC(CN1C(=O)Oc2cc(ccc12)S(N1CCCCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3136 |
| logD: | 4.3136 |
| logSw: | -4.2939 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.258 |
| InChI Key: | DNVOSBSZHBVGOZ-UHFFFAOYSA-N |