4-[(2,4-dichloroanilino)methylidene]-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[(2,4-dichloroanilino)methylidene]-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
4-[(2,4-dichloroanilino)methylidene]-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | Y501-3540 |
| Compound Name: | 4-[(2,4-dichloroanilino)methylidene]-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 364.2 |
| Molecular Formula: | C17 H12 Cl2 F N3 O |
| Smiles: | CC1/C(=C/Nc2ccc(cc2[Cl])[Cl])C(N(c2ccc(cc2)F)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5283 |
| logD: | 4.4806 |
| logSw: | -4.5561 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.49 |
| InChI Key: | RFZYRNACYBNLHT-UHFFFAOYSA-N |