2-(2-methylphenyl)-4-{[3-(trifluoromethyl)anilino]methylidene}isoquinoline-1,3(2H,4H)-dione
Chemical Structure Depiction of
2-(2-methylphenyl)-4-{[3-(trifluoromethyl)anilino]methylidene}isoquinoline-1,3(2H,4H)-dione
2-(2-methylphenyl)-4-{[3-(trifluoromethyl)anilino]methylidene}isoquinoline-1,3(2H,4H)-dione
Compound characteristics
| Compound ID: | 5122-2910 |
| Compound Name: | 2-(2-methylphenyl)-4-{[3-(trifluoromethyl)anilino]methylidene}isoquinoline-1,3(2H,4H)-dione |
| Molecular Weight: | 422.41 |
| Molecular Formula: | C24 H17 F3 N2 O2 |
| Smiles: | Cc1ccccc1N1C(C(=C/Nc2cccc(c2)C(F)(F)F)/c2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9642 |
| logD: | 4.9609 |
| logSw: | -4.6539 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.542 |
| InChI Key: | KSWBGBVUHPYPJC-UHFFFAOYSA-N |