2-[6-(azepane-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-(2,2-diethoxyethyl)acetamide
Chemical Structure Depiction of
2-[6-(azepane-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-(2,2-diethoxyethyl)acetamide
2-[6-(azepane-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-(2,2-diethoxyethyl)acetamide
Compound characteristics
| Compound ID: | C534-0608 |
| Compound Name: | 2-[6-(azepane-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-(2,2-diethoxyethyl)acetamide |
| Molecular Weight: | 483.58 |
| Molecular Formula: | C22 H33 N3 O7 S |
| Smiles: | CCOC(CNC(CN1C(COc2ccc(cc12)S(N1CCCCCC1)(=O)=O)=O)=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 1.4208 |
| logD: | 1.4208 |
| logSw: | -2.6698 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.507 |
| InChI Key: | UWDJQKACKONJAW-UHFFFAOYSA-N |