2-bromo-6-({2-[4-(3,4-dimethylanilino)-6-(4-nitroanilino)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-4-nitrophenol
Chemical Structure Depiction of
2-bromo-6-({2-[4-(3,4-dimethylanilino)-6-(4-nitroanilino)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-4-nitrophenol
2-bromo-6-({2-[4-(3,4-dimethylanilino)-6-(4-nitroanilino)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-4-nitrophenol
Compound characteristics
| Compound ID: | 8004-1114 |
| Compound Name: | 2-bromo-6-({2-[4-(3,4-dimethylanilino)-6-(4-nitroanilino)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-4-nitrophenol |
| Molecular Weight: | 594.38 |
| Molecular Formula: | C24 H20 Br N9 O5 |
| Smiles: | Cc1ccc(cc1C)Nc1nc(Nc2ccc(cc2)[N+]([O-])=O)nc(N/N=C/c2cc(cc(c2O)[Br])[N+]([O-])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 8.2132 |
| logD: | 6.1192 |
| logSw: | -5.7294 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 154.711 |
| InChI Key: | UJTNNIIGWQXPDS-UHFFFAOYSA-N |