N-(4-bromophenyl)-3-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanamide
Chemical Structure Depiction of
N-(4-bromophenyl)-3-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanamide
N-(4-bromophenyl)-3-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanamide
Compound characteristics
| Compound ID: | 2595-1316 |
| Compound Name: | N-(4-bromophenyl)-3-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanamide |
| Molecular Weight: | 418.2 |
| Molecular Formula: | C17 H12 Br N3 O5 |
| Smiles: | C(CN1C(c2cccc(c2C1=O)[N+]([O-])=O)=O)C(Nc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 2.1849 |
| logD: | 2.1844 |
| logSw: | -3.0169 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.7 |
| InChI Key: | FBHNTCYHRFLQAT-UHFFFAOYSA-N |