2-[6-(azepane-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-{3-[(propan-2-yl)oxy]propyl}acetamide
Chemical Structure Depiction of
2-[6-(azepane-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-{3-[(propan-2-yl)oxy]propyl}acetamide
2-[6-(azepane-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-{3-[(propan-2-yl)oxy]propyl}acetamide
Compound characteristics
| Compound ID: | E589-3831 |
| Compound Name: | 2-[6-(azepane-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-{3-[(propan-2-yl)oxy]propyl}acetamide |
| Molecular Weight: | 467.58 |
| Molecular Formula: | C22 H33 N3 O6 S |
| Smiles: | CC(C)OCCCNC(CN1C(COc2ccc(cc12)S(N1CCCCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6558 |
| logD: | 1.6558 |
| logSw: | -2.6946 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.896 |
| InChI Key: | JGQWUWNKBBHEDH-UHFFFAOYSA-N |