3-oxo-2-propyl-N-{[2-(trifluoromethyl)phenyl]methyl}-1,2,3,4-tetrahydroisoquinoline-1-carboxamide
Chemical Structure Depiction of
3-oxo-2-propyl-N-{[2-(trifluoromethyl)phenyl]methyl}-1,2,3,4-tetrahydroisoquinoline-1-carboxamide
3-oxo-2-propyl-N-{[2-(trifluoromethyl)phenyl]methyl}-1,2,3,4-tetrahydroisoquinoline-1-carboxamide
Compound characteristics
| Compound ID: | M575-0331 |
| Compound Name: | 3-oxo-2-propyl-N-{[2-(trifluoromethyl)phenyl]methyl}-1,2,3,4-tetrahydroisoquinoline-1-carboxamide |
| Molecular Weight: | 390.4 |
| Molecular Formula: | C21 H21 F3 N2 O2 |
| Smiles: | CCCN1C(C(NCc2ccccc2C(F)(F)F)=O)c2ccccc2CC1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9583 |
| logD: | 3.9582 |
| logSw: | -4.0099 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.864 |
| InChI Key: | ZQKPNCKKILNVLU-LJQANCHMSA-N |