2-({2-[4-(dimethylamino)-6-(4-fluoroanilino)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-4-nitrophenol--acetic acid (1/1)
Chemical Structure Depiction of
2-({2-[4-(dimethylamino)-6-(4-fluoroanilino)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-4-nitrophenol--acetic acid (1/1)
2-({2-[4-(dimethylamino)-6-(4-fluoroanilino)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-4-nitrophenol--acetic acid (1/1)
Compound characteristics
| Compound ID: | 8007-0050 |
| Compound Name: | 2-({2-[4-(dimethylamino)-6-(4-fluoroanilino)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-4-nitrophenol--acetic acid (1/1) |
| Molecular Weight: | 472.43 |
| Molecular Formula: | C18 H17 F N8 O3 |
| Salt: | CH3COOH |
| Smiles: | CN(C)c1nc(Nc2ccc(cc2)F)nc(N/N=C/c2cc(ccc2O)[N+]([O-])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.0157 |
| logD: | 4.1068 |
| logSw: | -4.5024 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 114.084 |
| InChI Key: | KHFJZSIAVYUFSR-KEBDBYFISA-N |