2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]-N-[2-(3-methylthiophen-2-yl)ethyl]acetamide
Chemical Structure Depiction of
2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]-N-[2-(3-methylthiophen-2-yl)ethyl]acetamide
2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]-N-[2-(3-methylthiophen-2-yl)ethyl]acetamide
Compound characteristics
| Compound ID: | K906-2907 |
| Compound Name: | 2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]-N-[2-(3-methylthiophen-2-yl)ethyl]acetamide |
| Molecular Weight: | 477.6 |
| Molecular Formula: | C22 H27 N3 O5 S2 |
| Smiles: | Cc1ccsc1CCNC(CN1C(=O)Oc2cc(ccc12)S(N1CCCCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1012 |
| logD: | 3.1012 |
| logSw: | -3.5186 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.44 |
| InChI Key: | CKDGXEFKSCCFKX-UHFFFAOYSA-N |