N-(4-bromo-2-nitrophenyl)-7-nitro-2,1,3-benzoxadiazol-4-amine
Chemical Structure Depiction of
N-(4-bromo-2-nitrophenyl)-7-nitro-2,1,3-benzoxadiazol-4-amine
N-(4-bromo-2-nitrophenyl)-7-nitro-2,1,3-benzoxadiazol-4-amine
Compound characteristics
| Compound ID: | 8020-6775 |
| Compound Name: | N-(4-bromo-2-nitrophenyl)-7-nitro-2,1,3-benzoxadiazol-4-amine |
| Molecular Weight: | 380.11 |
| Molecular Formula: | C12 H6 Br N5 O5 |
| Smiles: | c1cc(c(cc1[Br])[N+]([O-])=O)Nc1ccc(c2c1non2)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.7214 |
| logD: | 4.7213 |
| logSw: | -4.862 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 110.777 |
| InChI Key: | VKBWZNTZFUWTAP-UHFFFAOYSA-N |