N-(4-bromo-2-fluorophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine
Chemical Structure Depiction of
N-(4-bromo-2-fluorophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine
N-(4-bromo-2-fluorophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine
Compound characteristics
| Compound ID: | K034-0037 |
| Compound Name: | N-(4-bromo-2-fluorophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine |
| Molecular Weight: | 353.1 |
| Molecular Formula: | C12 H6 Br F N4 O3 |
| Smiles: | c1cc(c(cc1[Br])F)Nc1ccc2c(c1[N+]([O-])=O)non2 |
| Stereo: | ACHIRAL |
| logP: | 5.0455 |
| logD: | 5.0455 |
| logSw: | -5.101 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.625 |
| InChI Key: | QJXTUQPTDRJTRJ-UHFFFAOYSA-N |