4-[(3,4-dimethoxyanilino)methylidene]-2-(2-methylphenyl)isoquinoline-1,3(2H,4H)-dione
Chemical Structure Depiction of
4-[(3,4-dimethoxyanilino)methylidene]-2-(2-methylphenyl)isoquinoline-1,3(2H,4H)-dione
4-[(3,4-dimethoxyanilino)methylidene]-2-(2-methylphenyl)isoquinoline-1,3(2H,4H)-dione
Compound characteristics
| Compound ID: | 5122-2909 |
| Compound Name: | 4-[(3,4-dimethoxyanilino)methylidene]-2-(2-methylphenyl)isoquinoline-1,3(2H,4H)-dione |
| Molecular Weight: | 414.46 |
| Molecular Formula: | C25 H22 N2 O4 |
| Smiles: | Cc1ccccc1N1C(C(=C/Nc2ccc(c(c2)OC)OC)/c2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4559 |
| logD: | 3.4555 |
| logSw: | -3.8477 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.803 |
| InChI Key: | BBHXIXPLFJODEV-UHFFFAOYSA-N |