2-({2-[4-(3,5-dimethyl-1H-pyrazol-1-yl)-6-(4-methylanilino)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-4-nitrophenol
Chemical Structure Depiction of
2-({2-[4-(3,5-dimethyl-1H-pyrazol-1-yl)-6-(4-methylanilino)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-4-nitrophenol
2-({2-[4-(3,5-dimethyl-1H-pyrazol-1-yl)-6-(4-methylanilino)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-4-nitrophenol
Compound characteristics
| Compound ID: | Y508-3640 |
| Compound Name: | 2-({2-[4-(3,5-dimethyl-1H-pyrazol-1-yl)-6-(4-methylanilino)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-4-nitrophenol |
| Molecular Weight: | 459.47 |
| Molecular Formula: | C22 H21 N9 O3 |
| Smiles: | Cc1ccc(cc1)Nc1nc(N/N=C/c2cc(ccc2O)[N+]([O-])=O)nc(n1)n1c(C)cc(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.3345 |
| logD: | 4.4256 |
| logSw: | -5.2445 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 125.151 |
| InChI Key: | NPBAUQVYCYBUFC-UHFFFAOYSA-N |