2-[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
2-[1,3-dioxo-5-(4-oxo-4H-3,1-benzoxazin-2-yl)-1,3-dihydro-2H-isoindol-2-yl]phenyl acetate
2-[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: | 4334-0106 |
| Compound Name: | 2-[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)Oc1ccccc1N1C(c2ccc(cc2C1=O)C1=Nc2ccccc2C(=O)O1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0084 |
| logD: | 3.0084 |
| logSw: | -3.6288 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 79.364 |
| InChI Key: | TVUQPWDKTVCQJG-UHFFFAOYSA-N |