N-(2-bromo-4,6-dinitrophenyl)-4-nitrobenzamide
Chemical Structure Depiction of
N-(2-bromo-4,6-dinitrophenyl)-4-nitrobenzamide
N-(2-bromo-4,6-dinitrophenyl)-4-nitrobenzamide
Compound characteristics
| Compound ID: | Y508-1179 |
| Compound Name: | N-(2-bromo-4,6-dinitrophenyl)-4-nitrobenzamide |
| Molecular Weight: | 411.12 |
| Molecular Formula: | C13 H7 Br N4 O7 |
| Smiles: | c1cc(ccc1C(Nc1c(cc(cc1[Br])[N+]([O-])=O)[N+]([O-])=O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.0684 |
| logD: | -1.0531 |
| logSw: | -3.5817 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 121.778 |
| InChI Key: | CUTUJPVAKIGJKC-UHFFFAOYSA-N |