3-[5-(3-nitrobenzoyl)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]propyl acetate
Chemical Structure Depiction of
3-[5-(3-nitrobenzoyl)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]propyl acetate
3-[5-(3-nitrobenzoyl)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]propyl acetate
Compound characteristics
| Compound ID: | 3289-8848 |
| Compound Name: | 3-[5-(3-nitrobenzoyl)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]propyl acetate |
| Molecular Weight: | 396.35 |
| Molecular Formula: | C20 H16 N2 O7 |
| Smiles: | CC(=O)OCCCN1C(c2ccc(cc2C1=O)C(c1cccc(c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0144 |
| logD: | 3.0144 |
| logSw: | -3.3868 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 97.739 |
| InChI Key: | OZVAETSMBRSXQH-UHFFFAOYSA-N |