2-[6-(azepane-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-(2-methylcyclohexyl)acetamide
Chemical Structure Depiction of
2-[6-(azepane-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-(2-methylcyclohexyl)acetamide
2-[6-(azepane-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-(2-methylcyclohexyl)acetamide
Compound characteristics
| Compound ID: | E589-3812 |
| Compound Name: | 2-[6-(azepane-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-(2-methylcyclohexyl)acetamide |
| Molecular Weight: | 463.6 |
| Molecular Formula: | C23 H33 N3 O5 S |
| Smiles: | CC1CCCCC1NC(CN1C(COc2ccc(cc12)S(N1CCCCCC1)(=O)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.2373 |
| logD: | 3.2373 |
| logSw: | -3.8183 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.697 |
| InChI Key: | MCDFXWVKROHBBM-UHFFFAOYSA-N |