4-(6-bromo-4-oxo-4H-3,1-benzoxazin-2-yl)-2-methoxyphenyl acetate
Chemical Structure Depiction of
4-(6-bromo-4-oxo-4H-3,1-benzoxazin-2-yl)-2-methoxyphenyl acetate
4-(6-bromo-4-oxo-4H-3,1-benzoxazin-2-yl)-2-methoxyphenyl acetate
Compound characteristics
| Compound ID: | 5522-0174 |
| Compound Name: | 4-(6-bromo-4-oxo-4H-3,1-benzoxazin-2-yl)-2-methoxyphenyl acetate |
| Molecular Weight: | 390.19 |
| Molecular Formula: | C17 H12 Br N O5 |
| Smiles: | CC(=O)Oc1ccc(cc1OC)C1=Nc2ccc(cc2C(=O)O1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.0445 |
| logD: | 3.0445 |
| logSw: | -3.5069 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.654 |
| InChI Key: | HIXJOACXVKGBMO-UHFFFAOYSA-N |