2-phenyl-4-{[3-(trifluoromethyl)anilino]methylidene}isoquinoline-1,3(2H,4H)-dione
Chemical Structure Depiction of
2-phenyl-4-{[3-(trifluoromethyl)anilino]methylidene}isoquinoline-1,3(2H,4H)-dione
2-phenyl-4-{[3-(trifluoromethyl)anilino]methylidene}isoquinoline-1,3(2H,4H)-dione
Compound characteristics
| Compound ID: | 5122-2829 |
| Compound Name: | 2-phenyl-4-{[3-(trifluoromethyl)anilino]methylidene}isoquinoline-1,3(2H,4H)-dione |
| Molecular Weight: | 408.38 |
| Molecular Formula: | C23 H15 F3 N2 O2 |
| Smiles: | C(=C1C(N(C(c2ccccc\12)=O)c1ccccc1)=O)\Nc1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.363 |
| logD: | 4.3597 |
| logSw: | -4.5222 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.843 |
| InChI Key: | CVODYXBHNKBITK-UHFFFAOYSA-N |