2-[6-(azepane-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-cyclooctylacetamide
Chemical Structure Depiction of
2-[6-(azepane-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-cyclooctylacetamide
2-[6-(azepane-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-cyclooctylacetamide
Compound characteristics
| Compound ID: | E589-3720 |
| Compound Name: | 2-[6-(azepane-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-cyclooctylacetamide |
| Molecular Weight: | 477.62 |
| Molecular Formula: | C24 H35 N3 O5 S |
| Smiles: | C1CCCC(CCC1)NC(CN1C(COc2ccc(cc12)S(N1CCCCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8614 |
| logD: | 3.8614 |
| logSw: | -3.9964 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.638 |
| InChI Key: | KZZQOCANHIPBFE-UHFFFAOYSA-N |