2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzothiazol-3(2H)-yl]-N-(3-chloro-2-methylphenyl)acetamide
Chemical Structure Depiction of
2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzothiazol-3(2H)-yl]-N-(3-chloro-2-methylphenyl)acetamide
2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzothiazol-3(2H)-yl]-N-(3-chloro-2-methylphenyl)acetamide
Compound characteristics
| Compound ID: | F943-2435 |
| Compound Name: | 2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzothiazol-3(2H)-yl]-N-(3-chloro-2-methylphenyl)acetamide |
| Molecular Weight: | 494.03 |
| Molecular Formula: | C22 H24 Cl N3 O4 S2 |
| Smiles: | Cc1c(cccc1[Cl])NC(CN1C(=O)Sc2cc(ccc12)S(N1CCCCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0396 |
| logD: | 5.0394 |
| logSw: | -5.1935 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.305 |
| InChI Key: | RPYNAWHQMKEAOF-UHFFFAOYSA-N |