1-(3,4-dihydroquinolin-1(2H)-yl)-2-{[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-(3,4-dihydroquinolin-1(2H)-yl)-2-{[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}ethan-1-one
1-(3,4-dihydroquinolin-1(2H)-yl)-2-{[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | 7213-0082 |
| Compound Name: | 1-(3,4-dihydroquinolin-1(2H)-yl)-2-{[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 429.46 |
| Molecular Formula: | C22 H18 F3 N3 O S |
| Smiles: | C1Cc2ccccc2N(C1)C(CSc1nc(cc(C(F)(F)F)n1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6382 |
| logD: | 5.6382 |
| logSw: | -5.8427 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.046 |
| InChI Key: | JUHAJNVTDOYBPQ-UHFFFAOYSA-N |