2-(3,4-dichlorophenyl)-5-methyl-4-[(3,4,5-trimethoxyphenyl)methylidene]-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
2-(3,4-dichlorophenyl)-5-methyl-4-[(3,4,5-trimethoxyphenyl)methylidene]-2,4-dihydro-3H-pyrazol-3-one
2-(3,4-dichlorophenyl)-5-methyl-4-[(3,4,5-trimethoxyphenyl)methylidene]-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 2083-0091 |
| Compound Name: | 2-(3,4-dichlorophenyl)-5-methyl-4-[(3,4,5-trimethoxyphenyl)methylidene]-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 421.28 |
| Molecular Formula: | C20 H18 Cl2 N2 O4 |
| Smiles: | CC1/C(=C\c2cc(c(c(c2)OC)OC)OC)C(N(c2ccc(c(c2)[Cl])[Cl])N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6801 |
| logD: | 4.6801 |
| logSw: | -5.0156 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.565 |
| InChI Key: | PWBFXJYOWDQSCE-UHFFFAOYSA-N |