4-methoxyphenyl 1-oxo-2-[3-(trifluoromethyl)phenyl]-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
4-methoxyphenyl 1-oxo-2-[3-(trifluoromethyl)phenyl]-1,2-dihydroisoquinoline-4-carboxylate
4-methoxyphenyl 1-oxo-2-[3-(trifluoromethyl)phenyl]-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | G817-1874 |
| Compound Name: | 4-methoxyphenyl 1-oxo-2-[3-(trifluoromethyl)phenyl]-1,2-dihydroisoquinoline-4-carboxylate |
| Molecular Weight: | 439.39 |
| Molecular Formula: | C24 H16 F3 N O4 |
| Smiles: | COc1ccc(cc1)OC(C1=CN(C(c2ccccc12)=O)c1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5404 |
| logD: | 4.5404 |
| logSw: | -4.6578 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.676 |
| InChI Key: | HQTGNOZSLRGVHP-UHFFFAOYSA-N |