propan-2-yl 1-{[3-(methoxycarbonyl)phenyl]methyl}-2-methyl-6-oxo-4-[4-(trifluoromethyl)phenyl]-1,4,5,6-tetrahydropyridine-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 1-{[3-(methoxycarbonyl)phenyl]methyl}-2-methyl-6-oxo-4-[4-(trifluoromethyl)phenyl]-1,4,5,6-tetrahydropyridine-3-carboxylate
propan-2-yl 1-{[3-(methoxycarbonyl)phenyl]methyl}-2-methyl-6-oxo-4-[4-(trifluoromethyl)phenyl]-1,4,5,6-tetrahydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | V005-8909 |
| Compound Name: | propan-2-yl 1-{[3-(methoxycarbonyl)phenyl]methyl}-2-methyl-6-oxo-4-[4-(trifluoromethyl)phenyl]-1,4,5,6-tetrahydropyridine-3-carboxylate |
| Molecular Weight: | 489.49 |
| Molecular Formula: | C26 H26 F3 N O5 |
| Smiles: | CC(C)OC(C1C(CC(N(Cc2cccc(c2)C(=O)OC)C=1C)=O)c1ccc(cc1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2486 |
| logD: | 5.2486 |
| logSw: | -5.0884 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.455 |
| InChI Key: | MQLSKNUGFHEQQT-NRFANRHFSA-N |