4-(5-bromo-6-methyl-4-oxo-4H-3,1-benzoxazin-2-yl)phenyl acetate
Chemical Structure Depiction of
4-(5-bromo-6-methyl-4-oxo-4H-3,1-benzoxazin-2-yl)phenyl acetate
4-(5-bromo-6-methyl-4-oxo-4H-3,1-benzoxazin-2-yl)phenyl acetate
Compound characteristics
| Compound ID: | 8015-5008 |
| Compound Name: | 4-(5-bromo-6-methyl-4-oxo-4H-3,1-benzoxazin-2-yl)phenyl acetate |
| Molecular Weight: | 374.19 |
| Molecular Formula: | C17 H12 Br N O4 |
| Smiles: | CC(=O)Oc1ccc(cc1)C1=Nc2ccc(C)c(c2C(=O)O1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.3331 |
| logD: | 3.3331 |
| logSw: | -3.7018 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.937 |
| InChI Key: | CJFAUHZHSKDLCY-UHFFFAOYSA-N |