4-[(1-ethyl-1H-pyrazol-3-yl)methylidene]-5-(pentafluoroethyl)-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[(1-ethyl-1H-pyrazol-3-yl)methylidene]-5-(pentafluoroethyl)-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
4-[(1-ethyl-1H-pyrazol-3-yl)methylidene]-5-(pentafluoroethyl)-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | Y508-4418 |
| Compound Name: | 4-[(1-ethyl-1H-pyrazol-3-yl)methylidene]-5-(pentafluoroethyl)-2-phenyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 384.31 |
| Molecular Formula: | C17 H13 F5 N4 O |
| Smiles: | CCn1ccc(\C=C2/C(C(C(F)(F)F)(F)F)=NN(C2=O)c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.212 |
| logD: | 3.212 |
| logSw: | -3.303 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.294 |
| InChI Key: | CBEWOKOBQKAQTR-UHFFFAOYSA-N |