3-[5-(4-nitrophenoxy)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]phenyl acetate
Chemical Structure Depiction of
3-[5-(4-nitrophenoxy)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]phenyl acetate
3-[5-(4-nitrophenoxy)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]phenyl acetate
Compound characteristics
| Compound ID: | 8003-0855 |
| Compound Name: | 3-[5-(4-nitrophenoxy)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]phenyl acetate |
| Molecular Weight: | 418.36 |
| Molecular Formula: | C22 H14 N2 O7 |
| Smiles: | CC(=O)Oc1cccc(c1)N1C(c2ccc(cc2C1=O)Oc1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0359 |
| logD: | 4.0359 |
| logSw: | -4.2749 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 89.76 |
| InChI Key: | ISYUHRVCCJZCMQ-UHFFFAOYSA-N |