4-[(3,4-dimethylanilino)methylidene]-2-(4-fluorophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[(3,4-dimethylanilino)methylidene]-2-(4-fluorophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one
4-[(3,4-dimethylanilino)methylidene]-2-(4-fluorophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8012-4645 |
| Compound Name: | 4-[(3,4-dimethylanilino)methylidene]-2-(4-fluorophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 351.42 |
| Molecular Formula: | C21 H22 F N3 O |
| Smiles: | CCCC1/C(=C/Nc2ccc(C)c(C)c2)C(N(c2ccc(cc2)F)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0724 |
| logD: | 5.048 |
| logSw: | -4.7043 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.918 |
| InChI Key: | ZDCPTMZHKNGIKQ-UHFFFAOYSA-N |