3-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxo-N-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
3-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxo-N-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
3-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxo-N-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C096-0726 |
| Compound Name: | 3-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxo-N-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 486.47 |
| Molecular Formula: | C26 H22 F4 N2 O3 |
| Smiles: | COCCN1C(C(C(Nc2ccc(cc2)C(F)(F)F)=O)c2ccccc2C1=O)c1ccc(cc1)F |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8138 |
| logD: | 4.8136 |
| logSw: | -4.5361 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.335 |
| InChI Key: | ZKJPPYRAZKNKSV-UHFFFAOYSA-N |