3-[6-(acetyloxy)-4-oxo-4H-3,1-benzoxazin-2-yl]phenyl acetate
Chemical Structure Depiction of
3-[6-(acetyloxy)-4-oxo-4H-3,1-benzoxazin-2-yl]phenyl acetate
3-[6-(acetyloxy)-4-oxo-4H-3,1-benzoxazin-2-yl]phenyl acetate
Compound characteristics
| Compound ID: | 4334-1447 |
| Compound Name: | 3-[6-(acetyloxy)-4-oxo-4H-3,1-benzoxazin-2-yl]phenyl acetate |
| Molecular Weight: | 339.3 |
| Molecular Formula: | C18 H13 N O6 |
| Smiles: | CC(=O)Oc1cccc(c1)C1=Nc2ccc(cc2C(=O)O1)OC(C)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6305 |
| logD: | 1.6305 |
| logSw: | -2.2177 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 71.688 |
| InChI Key: | VQCCGTYZNIJVKF-UHFFFAOYSA-N |