4-[(3-fluoroanilino)methylidene]-2-(4-nitrophenyl)-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[(3-fluoroanilino)methylidene]-2-(4-nitrophenyl)-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
4-[(3-fluoroanilino)methylidene]-2-(4-nitrophenyl)-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8007-3032 |
| Compound Name: | 4-[(3-fluoroanilino)methylidene]-2-(4-nitrophenyl)-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 394.28 |
| Molecular Formula: | C17 H10 F4 N4 O3 |
| Smiles: | C(=C1/C(C(F)(F)F)=NN(C1=O)c1ccc(cc1)[N+]([O-])=O)\Nc1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 3.6763 |
| logD: | 3.4447 |
| logSw: | -4.0459 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.396 |
| InChI Key: | GNKGXLMEMWQTLO-UHFFFAOYSA-N |