2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]-N-(3-chlorophenyl)acetamide
Chemical Structure Depiction of
2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]-N-(3-chlorophenyl)acetamide
2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]-N-(3-chlorophenyl)acetamide
Compound characteristics
| Compound ID: | C989-0288 |
| Compound Name: | 2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]-N-(3-chlorophenyl)acetamide |
| Molecular Weight: | 463.94 |
| Molecular Formula: | C21 H22 Cl N3 O5 S |
| Smiles: | C1CCCN(CC1)S(c1ccc2c(c1)OC(N2CC(Nc1cccc(c1)[Cl])=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0797 |
| logD: | 4.0796 |
| logSw: | -4.4478 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.258 |
| InChI Key: | QVWCNRJMENMYDK-UHFFFAOYSA-N |