4-[(3,4-dimethoxyanilino)methylidene]-2-phenylisoquinoline-1,3(2H,4H)-dione
Chemical Structure Depiction of
4-[(3,4-dimethoxyanilino)methylidene]-2-phenylisoquinoline-1,3(2H,4H)-dione
4-[(3,4-dimethoxyanilino)methylidene]-2-phenylisoquinoline-1,3(2H,4H)-dione
Compound characteristics
| Compound ID: | 5122-2828 |
| Compound Name: | 4-[(3,4-dimethoxyanilino)methylidene]-2-phenylisoquinoline-1,3(2H,4H)-dione |
| Molecular Weight: | 400.43 |
| Molecular Formula: | C24 H20 N2 O4 |
| Smiles: | COc1ccc(cc1OC)N/C=C1C(N(C(c2ccccc\12)=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8547 |
| logD: | 2.8543 |
| logSw: | -3.5715 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.104 |
| InChI Key: | OQRFCBMMEIJQQV-UHFFFAOYSA-N |