2-({2-[4-(4-fluoroanilino)-6-(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-4-nitrophenol
Chemical Structure Depiction of
2-({2-[4-(4-fluoroanilino)-6-(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-4-nitrophenol
2-({2-[4-(4-fluoroanilino)-6-(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-4-nitrophenol
Compound characteristics
| Compound ID: | 8006-2666 |
| Compound Name: | 2-({2-[4-(4-fluoroanilino)-6-(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)-4-nitrophenol |
| Molecular Weight: | 452.45 |
| Molecular Formula: | C21 H21 F N8 O3 |
| Smiles: | C1CCN(CC1)c1nc(Nc2ccc(cc2)F)nc(N/N=C/c2cc(ccc2O)[N+]([O-])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.1038 |
| logD: | 5.1949 |
| logSw: | -5.6776 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 114.732 |
| InChI Key: | IBMITUZMADBVBV-UHFFFAOYSA-N |