4-[5-(3-nitrobenzoyl)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]phenyl acetate
Chemical Structure Depiction of
4-[5-(3-nitrobenzoyl)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]phenyl acetate
4-[5-(3-nitrobenzoyl)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]phenyl acetate
Compound characteristics
| Compound ID: | 8002-6881 |
| Compound Name: | 4-[5-(3-nitrobenzoyl)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]phenyl acetate |
| Molecular Weight: | 430.37 |
| Molecular Formula: | C23 H14 N2 O7 |
| Smiles: | CC(=O)Oc1ccc(cc1)N1C(c2ccc(cc2C1=O)C(c1cccc(c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7391 |
| logD: | 3.7391 |
| logSw: | -4.1233 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 96.479 |
| InChI Key: | LUMIFOOVPDLHMF-UHFFFAOYSA-N |