5-(4-fluorophenyl)-N'-[(E)-(1-methyl-1H-pyrazol-4-yl)methylidene]-7-(pentafluoroethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carbohydrazide
Chemical Structure Depiction of
5-(4-fluorophenyl)-N'-[(E)-(1-methyl-1H-pyrazol-4-yl)methylidene]-7-(pentafluoroethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carbohydrazide
5-(4-fluorophenyl)-N'-[(E)-(1-methyl-1H-pyrazol-4-yl)methylidene]-7-(pentafluoroethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carbohydrazide
Compound characteristics
| Compound ID: | Y501-9441 |
| Compound Name: | 5-(4-fluorophenyl)-N'-[(E)-(1-methyl-1H-pyrazol-4-yl)methylidene]-7-(pentafluoroethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carbohydrazide |
| Molecular Weight: | 485.39 |
| Molecular Formula: | C20 H17 F6 N7 O |
| Smiles: | Cn1cc(/C=N/NC(c2cc3NC(CC(C(C(F)(F)F)(F)F)n3n2)c2ccc(cc2)F)=O)cn1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.4979 |
| logD: | 3.4978 |
| logSw: | -3.5957 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.891 |
| InChI Key: | XAFFDTKFPBFLRM-UHFFFAOYSA-N |