2-[(2-benzoyl-4-chloroanilino)methylidene]-5-(4-methylphenyl)cyclohexane-1,3-dione
Chemical Structure Depiction of
2-[(2-benzoyl-4-chloroanilino)methylidene]-5-(4-methylphenyl)cyclohexane-1,3-dione
2-[(2-benzoyl-4-chloroanilino)methylidene]-5-(4-methylphenyl)cyclohexane-1,3-dione
Compound characteristics
| Compound ID: | 4038-0151 |
| Compound Name: | 2-[(2-benzoyl-4-chloroanilino)methylidene]-5-(4-methylphenyl)cyclohexane-1,3-dione |
| Molecular Weight: | 443.93 |
| Molecular Formula: | C27 H22 Cl N O3 |
| Smiles: | Cc1ccc(cc1)C1CC(C(=CNc2ccc(cc2C(c2ccccc2)=O)[Cl])C(C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0007 |
| logD: | 4.256 |
| logSw: | -6.1653 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.753 |
| InChI Key: | XVQRJJYWDAELSB-UHFFFAOYSA-N |