naphthalen-2-yl 4-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate
Chemical Structure Depiction of
naphthalen-2-yl 4-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate
naphthalen-2-yl 4-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate
Compound characteristics
| Compound ID: | 8006-8652 |
| Compound Name: | naphthalen-2-yl 4-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate |
| Molecular Weight: | 404.38 |
| Molecular Formula: | C22 H16 N2 O6 |
| Smiles: | C(CC(=O)Oc1ccc2ccccc2c1)CN1C(c2cccc(c2C1=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7311 |
| logD: | 2.7311 |
| logSw: | -3.6812 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 82.333 |
| InChI Key: | DWXUZHCVOWJVQO-UHFFFAOYSA-N |