4-[(3-chloro-4,5-diethoxyphenyl)methylidene]-1-(3-chloro-4-methylphenyl)pyrazolidine-3,5-dione
Chemical Structure Depiction of
4-[(3-chloro-4,5-diethoxyphenyl)methylidene]-1-(3-chloro-4-methylphenyl)pyrazolidine-3,5-dione
4-[(3-chloro-4,5-diethoxyphenyl)methylidene]-1-(3-chloro-4-methylphenyl)pyrazolidine-3,5-dione
Compound characteristics
| Compound ID: | 4167-0036 |
| Compound Name: | 4-[(3-chloro-4,5-diethoxyphenyl)methylidene]-1-(3-chloro-4-methylphenyl)pyrazolidine-3,5-dione |
| Molecular Weight: | 435.31 |
| Molecular Formula: | C21 H20 Cl2 N2 O4 |
| Smiles: | CCOc1cc(/C=C2/C(NN(C2=O)c2ccc(C)c(c2)[Cl])=O)cc(c1OCC)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.1074 |
| logD: | 4.7009 |
| logSw: | -5.6177 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.267 |
| InChI Key: | YEFVDCLKNNAPJL-UHFFFAOYSA-N |