4-[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
4-[1,3-dioxo-5-(4-oxo-4H-3,1-benzoxazin-2-yl)-1,3-dihydro-2H-isoindol-2-yl]phenyl acetate
4-[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: | 3289-5799 |
Compound Name: | 4-[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)Oc1ccc(cc1)N1C(c2ccc(cc2C1=O)C1=Nc2ccccc2C(=O)O1)=O |
Stereo: | ACHIRAL |
logP: | 2.9358 |
logD: | 2.9358 |
logSw: | -3.7001 |
Hydrogen bond acceptors count: | 11 |
Polar surface area: | 79.578 |
InChI Key: | HKXJKAJGMUVWGI-UHFFFAOYSA-N |