2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]-N-[(3-methoxyphenyl)methyl]acetamide
Chemical Structure Depiction of
2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]-N-[(3-methoxyphenyl)methyl]acetamide
2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]-N-[(3-methoxyphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | K906-2900 |
| Compound Name: | 2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]-N-[(3-methoxyphenyl)methyl]acetamide |
| Molecular Weight: | 473.55 |
| Molecular Formula: | C23 H27 N3 O6 S |
| Smiles: | COc1cccc(CNC(CN2C(=O)Oc3cc(ccc23)S(N2CCCCCC2)(=O)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.0012 |
| logD: | 3.0012 |
| logSw: | -3.6704 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.124 |
| InChI Key: | JXDXXBIWRLCZJD-UHFFFAOYSA-N |