2-({2-[4-(2,3-dimethylanilino)-6-(4-methylpiperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-4,6-dinitrophenol--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-({2-[4-(2,3-dimethylanilino)-6-(4-methylpiperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-4,6-dinitrophenol--hydrogen chloride (1/1)
2-({2-[4-(2,3-dimethylanilino)-6-(4-methylpiperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-4,6-dinitrophenol--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8007-8946 |
| Compound Name: | 2-({2-[4-(2,3-dimethylanilino)-6-(4-methylpiperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-4,6-dinitrophenol--hydrogen chloride (1/1) |
| Molecular Weight: | 558 |
| Molecular Formula: | C24 H27 N9 O5 |
| Salt: | HCl |
| Smiles: | CC1CCN(CC1)c1nc(Nc2cccc(C)c2C)nc(N/N=C/c2cc(cc(c2O)[N+]([O-])=O)[N+]([O-])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 7.3811 |
| logD: | 3.5472 |
| logSw: | -5.7551 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 146.046 |
| InChI Key: | IKEHNUNPLKCIDF-DHRITJCHSA-N |