2-[4-(difluoromethoxy)phenyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-[4-(difluoromethoxy)phenyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
2-[4-(difluoromethoxy)phenyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | Y500-7108 |
| Compound Name: | 2-[4-(difluoromethoxy)phenyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 348.37 |
| Molecular Formula: | C17 H14 F2 N2 O2 S |
| Smiles: | C1CCc2c(C1)c1C(NC(c3ccc(cc3)OC(F)F)=Nc1s2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8248 |
| logD: | 3.7996 |
| logSw: | -4.4928 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.319 |
| InChI Key: | DNOWRQKOFFVINN-UHFFFAOYSA-N |