3-phenyl-2-({[4-(1,1,2,2-tetrafluoroethoxy)phenyl]methyl}sulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-phenyl-2-({[4-(1,1,2,2-tetrafluoroethoxy)phenyl]methyl}sulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
3-phenyl-2-({[4-(1,1,2,2-tetrafluoroethoxy)phenyl]methyl}sulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 8010-3089 |
| Compound Name: | 3-phenyl-2-({[4-(1,1,2,2-tetrafluoroethoxy)phenyl]methyl}sulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 520.57 |
| Molecular Formula: | C25 H20 F4 N2 O2 S2 |
| Smiles: | C1CCc2c(C1)c1C(N(C(=Nc1s2)SCc1ccc(cc1)OC(C(F)F)(F)F)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0492 |
| logD: | 6.0492 |
| logSw: | -5.8327 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 31.0044 |
| InChI Key: | VKZZQWJJJAKWHY-UHFFFAOYSA-N |