4-chloro-2-methoxyphenyl 1-oxo-2-[3-(trifluoromethyl)phenyl]-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
4-chloro-2-methoxyphenyl 1-oxo-2-[3-(trifluoromethyl)phenyl]-1,2-dihydroisoquinoline-4-carboxylate
4-chloro-2-methoxyphenyl 1-oxo-2-[3-(trifluoromethyl)phenyl]-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | G817-1845 |
| Compound Name: | 4-chloro-2-methoxyphenyl 1-oxo-2-[3-(trifluoromethyl)phenyl]-1,2-dihydroisoquinoline-4-carboxylate |
| Molecular Weight: | 473.83 |
| Molecular Formula: | C24 H15 Cl F3 N O4 |
| Smiles: | COc1cc(ccc1OC(C1=CN(C(c2ccccc12)=O)c1cccc(c1)C(F)(F)F)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.253 |
| logD: | 5.253 |
| logSw: | -5.8186 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.849 |
| InChI Key: | DYOMFGGCOIRJOY-UHFFFAOYSA-N |