3-(trifluoromethyl)phenyl 2-(3-chlorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
3-(trifluoromethyl)phenyl 2-(3-chlorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
3-(trifluoromethyl)phenyl 2-(3-chlorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | G817-1805 |
| Compound Name: | 3-(trifluoromethyl)phenyl 2-(3-chlorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate |
| Molecular Weight: | 443.81 |
| Molecular Formula: | C23 H13 Cl F3 N O3 |
| Smiles: | C1=C(C(=O)Oc2cccc(c2)C(F)(F)F)c2ccccc2C(N1c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.078 |
| logD: | 5.078 |
| logSw: | -5.3708 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.132 |
| InChI Key: | MEYHRWYFLXTPHY-UHFFFAOYSA-N |