2,2,2-trifluoroethyl 1-oxo-2-phenyl-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
2,2,2-trifluoroethyl 1-oxo-2-phenyl-1,2-dihydroisoquinoline-4-carboxylate
2,2,2-trifluoroethyl 1-oxo-2-phenyl-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | G817-1460 |
| Compound Name: | 2,2,2-trifluoroethyl 1-oxo-2-phenyl-1,2-dihydroisoquinoline-4-carboxylate |
| Molecular Weight: | 347.29 |
| Molecular Formula: | C18 H12 F3 N O3 |
| Smiles: | C(C(F)(F)F)OC(C1=CN(C(c2ccccc12)=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9836 |
| logD: | 2.9836 |
| logSw: | -3.4788 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.884 |
| InChI Key: | FPYVPDAWJGHXQR-UHFFFAOYSA-N |