2-{[4-(4-fluorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}-1-(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)ethan-1-one
Chemical Structure Depiction of
2-{[4-(4-fluorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}-1-(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)ethan-1-one
2-{[4-(4-fluorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}-1-(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)ethan-1-one
Compound characteristics
| Compound ID: | 6466-0397 |
| Compound Name: | 2-{[4-(4-fluorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}-1-(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)ethan-1-one |
| Molecular Weight: | 467.53 |
| Molecular Formula: | C23 H25 F4 N3 O S |
| Smiles: | CC1(C)CC2CC(C)(C1)CN2C(CSc1nc(cc(C(F)(F)F)n1)c1ccc(cc1)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.8258 |
| logD: | 5.8258 |
| logSw: | -5.5172 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.067 |
| InChI Key: | GFEIGPCFLRGGCC-UHFFFAOYSA-N |