4-[(3-chloroanilino)methylidene]-2-(3,4-dimethylphenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[(3-chloroanilino)methylidene]-2-(3,4-dimethylphenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
4-[(3-chloroanilino)methylidene]-2-(3,4-dimethylphenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8005-3127 |
| Compound Name: | 4-[(3-chloroanilino)methylidene]-2-(3,4-dimethylphenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 339.82 |
| Molecular Formula: | C19 H18 Cl N3 O |
| Smiles: | CC1/C(=C/Nc2cccc(c2)[Cl])C(N(c2ccc(C)c(C)c2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.042 |
| logD: | 5.0378 |
| logSw: | -5.0891 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.188 |
| InChI Key: | AZPPAIHEFRNDJU-UHFFFAOYSA-N |