N-(2-bromo-4-methyl-5-nitrophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine
Chemical Structure Depiction of
N-(2-bromo-4-methyl-5-nitrophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine
N-(2-bromo-4-methyl-5-nitrophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine
Compound characteristics
| Compound ID: | 1616-0069 |
| Compound Name: | N-(2-bromo-4-methyl-5-nitrophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine |
| Molecular Weight: | 394.14 |
| Molecular Formula: | C13 H8 Br N5 O5 |
| Smiles: | Cc1cc(c(cc1[N+]([O-])=O)Nc1ccc2c(c1[N+]([O-])=O)non2)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.4427 |
| logD: | 5.4427 |
| logSw: | -5.5284 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 109.705 |
| InChI Key: | OUZLARSBRGGAIB-UHFFFAOYSA-N |