3-(trifluoromethyl)phenyl 1-oxo-2-phenyl-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
3-(trifluoromethyl)phenyl 1-oxo-2-phenyl-1,2-dihydroisoquinoline-4-carboxylate
3-(trifluoromethyl)phenyl 1-oxo-2-phenyl-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | G817-1435 |
| Compound Name: | 3-(trifluoromethyl)phenyl 1-oxo-2-phenyl-1,2-dihydroisoquinoline-4-carboxylate |
| Molecular Weight: | 409.36 |
| Molecular Formula: | C23 H14 F3 N O3 |
| Smiles: | C1=C(C(=O)Oc2cccc(c2)C(F)(F)F)c2ccccc2C(N1c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3018 |
| logD: | 4.3018 |
| logSw: | -4.6341 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.132 |
| InChI Key: | HPHSGAWCLDAJIR-UHFFFAOYSA-N |