1-(4-methoxyanilino)-N-[3-(trifluoromethyl)phenyl]isoquinoline-4-carboxamide
Chemical Structure Depiction of
1-(4-methoxyanilino)-N-[3-(trifluoromethyl)phenyl]isoquinoline-4-carboxamide
1-(4-methoxyanilino)-N-[3-(trifluoromethyl)phenyl]isoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C128-0012 |
| Compound Name: | 1-(4-methoxyanilino)-N-[3-(trifluoromethyl)phenyl]isoquinoline-4-carboxamide |
| Molecular Weight: | 437.42 |
| Molecular Formula: | C24 H18 F3 N3 O2 |
| Smiles: | COc1ccc(cc1)Nc1c2ccccc2c(cn1)C(Nc1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8719 |
| logD: | 5.8679 |
| logSw: | -5.8652 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.292 |
| InChI Key: | HUIVTFCXBLTBNX-UHFFFAOYSA-N |