2-[6-(azepane-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-[2-(azepan-1-yl)ethyl]acetamide
Chemical Structure Depiction of
2-[6-(azepane-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-[2-(azepan-1-yl)ethyl]acetamide
2-[6-(azepane-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-[2-(azepan-1-yl)ethyl]acetamide
Compound characteristics
| Compound ID: | E589-3871 |
| Compound Name: | 2-[6-(azepane-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-[2-(azepan-1-yl)ethyl]acetamide |
| Molecular Weight: | 492.64 |
| Molecular Formula: | C24 H36 N4 O5 S |
| Smiles: | C1CCCN(CC1)CCNC(CN1C(COc2ccc(cc12)S(N1CCCCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1647 |
| logD: | 0.6791 |
| logSw: | -2.9445 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.737 |
| InChI Key: | SBHXKYLIPMGTOM-UHFFFAOYSA-N |