2-(2-methylpropyl)-1-oxo-3-(thiophen-2-yl)-N-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-(2-methylpropyl)-1-oxo-3-(thiophen-2-yl)-N-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
2-(2-methylpropyl)-1-oxo-3-(thiophen-2-yl)-N-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-0688 |
| Compound Name: | 2-(2-methylpropyl)-1-oxo-3-(thiophen-2-yl)-N-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 472.53 |
| Molecular Formula: | C25 H23 F3 N2 O2 S |
| Smiles: | CC(C)CN1C(C(C(Nc2cccc(c2)C(F)(F)F)=O)c2ccccc2C1=O)c1cccs1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.862 |
| logD: | 5.8447 |
| logSw: | -5.6196 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.032 |
| InChI Key: | ONEHVUDKGAJECW-UHFFFAOYSA-N |