3-[1,3-dioxo-5-(4-oxo-4H-3,1-benzoxazin-2-yl)-1,3-dihydro-2H-isoindol-2-yl]phenyl acetate
Chemical Structure Depiction of
3-[1,3-dioxo-5-(4-oxo-4H-3,1-benzoxazin-2-yl)-1,3-dihydro-2H-isoindol-2-yl]phenyl acetate
3-[1,3-dioxo-5-(4-oxo-4H-3,1-benzoxazin-2-yl)-1,3-dihydro-2H-isoindol-2-yl]phenyl acetate
Compound characteristics
| Compound ID: | 8004-9036 |
| Compound Name: | 3-[1,3-dioxo-5-(4-oxo-4H-3,1-benzoxazin-2-yl)-1,3-dihydro-2H-isoindol-2-yl]phenyl acetate |
| Molecular Weight: | 426.38 |
| Molecular Formula: | C24 H14 N2 O6 |
| Smiles: | CC(=O)Oc1cccc(c1)N1C(c2ccc(cc2C1=O)C1=Nc2ccccc2C(=O)O1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0322 |
| logD: | 3.0322 |
| logSw: | -3.6328 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 79.578 |
| InChI Key: | JZQIXKMETNOQNA-UHFFFAOYSA-N |