4-[(benzylamino)methylidene]-2-(4-fluorophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[(benzylamino)methylidene]-2-(4-fluorophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one
4-[(benzylamino)methylidene]-2-(4-fluorophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8012-5371 |
| Compound Name: | 4-[(benzylamino)methylidene]-2-(4-fluorophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 337.4 |
| Molecular Formula: | C20 H20 F N3 O |
| Smiles: | CCCC1\C(=C/NCc2ccccc2)C(N(c2ccc(cc2)F)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2599 |
| logD: | 3.2472 |
| logSw: | -3.3547 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.449 |
| InChI Key: | SEQJYIXCEJRACN-UHFFFAOYSA-N |