2-(3-methoxyphenyl)-4-{[3-(trifluoromethyl)anilino]methylidene}isoquinoline-1,3(2H,4H)-dione
Chemical Structure Depiction of
2-(3-methoxyphenyl)-4-{[3-(trifluoromethyl)anilino]methylidene}isoquinoline-1,3(2H,4H)-dione
2-(3-methoxyphenyl)-4-{[3-(trifluoromethyl)anilino]methylidene}isoquinoline-1,3(2H,4H)-dione
Compound characteristics
| Compound ID: | 5122-2963 |
| Compound Name: | 2-(3-methoxyphenyl)-4-{[3-(trifluoromethyl)anilino]methylidene}isoquinoline-1,3(2H,4H)-dione |
| Molecular Weight: | 438.4 |
| Molecular Formula: | C24 H17 F3 N2 O3 |
| Smiles: | COc1cccc(c1)N1C(C(=C/Nc2cccc(c2)C(F)(F)F)/c2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6484 |
| logD: | 4.6451 |
| logSw: | -4.5523 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.387 |
| InChI Key: | QORFHYRSIBSXCJ-UHFFFAOYSA-N |