ethyl 8-(trifluoromethyl)-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)quinoline-3-carboxylate--hydrogen chloride (1/1)
Chemical Structure Depiction of
ethyl 8-(trifluoromethyl)-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)quinoline-3-carboxylate--hydrogen chloride (1/1)
ethyl 8-(trifluoromethyl)-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)quinoline-3-carboxylate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 5695-0999 |
| Compound Name: | ethyl 8-(trifluoromethyl)-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)quinoline-3-carboxylate--hydrogen chloride (1/1) |
| Molecular Weight: | 456.94 |
| Molecular Formula: | C23 H27 F3 N2 O2 |
| Salt: | HCl |
| Smiles: | CCOC(c1cnc2c(cccc2c1N1CC2(C)CC1CC(C)(C)C2)C(F)(F)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.666 |
| logD: | 5.666 |
| logSw: | -5.6625 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.151 |
| InChI Key: | POAQKNWWPAFEHI-UHFFFAOYSA-N |