4-nitro-2-[(2-{4-[2-(pyridin-2-yl)piperidin-1-yl]-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-yl}hydrazinylidene)methyl]phenol
Chemical Structure Depiction of
4-nitro-2-[(2-{4-[2-(pyridin-2-yl)piperidin-1-yl]-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-yl}hydrazinylidene)methyl]phenol
4-nitro-2-[(2-{4-[2-(pyridin-2-yl)piperidin-1-yl]-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-yl}hydrazinylidene)methyl]phenol
Compound characteristics
| Compound ID: | 8013-2020 |
| Compound Name: | 4-nitro-2-[(2-{4-[2-(pyridin-2-yl)piperidin-1-yl]-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-yl}hydrazinylidene)methyl]phenol |
| Molecular Weight: | 518.45 |
| Molecular Formula: | C22 H21 F3 N8 O4 |
| Smiles: | C1CCN(C(C1)c1ccccn1)c1nc(N/N=C/c2cc(ccc2O)[N+]([O-])=O)nc(n1)OCC(F)(F)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.248 |
| logD: | 4.3392 |
| logSw: | -5.0572 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 120.455 |
| InChI Key: | PNPJVFHIFPIQSF-KRWDZBQOSA-N |