2-[6-(azepane-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-[(4-methylphenyl)methyl]acetamide
Chemical Structure Depiction of
2-[6-(azepane-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-[(4-methylphenyl)methyl]acetamide
2-[6-(azepane-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-[(4-methylphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | E589-3746 |
| Compound Name: | 2-[6-(azepane-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-[(4-methylphenyl)methyl]acetamide |
| Molecular Weight: | 471.57 |
| Molecular Formula: | C24 H29 N3 O5 S |
| Smiles: | Cc1ccc(CNC(CN2C(COc3ccc(cc23)S(N2CCCCCC2)(=O)=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.0717 |
| logD: | 3.0717 |
| logSw: | -3.4934 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.582 |
| InChI Key: | OKDXBHVXBVTTRQ-UHFFFAOYSA-N |