3-[(2-fluorophenyl)methyl]-2-(2-oxo-2H-1-benzopyran-3-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-[(2-fluorophenyl)methyl]-2-(2-oxo-2H-1-benzopyran-3-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
3-[(2-fluorophenyl)methyl]-2-(2-oxo-2H-1-benzopyran-3-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C200-3193 |
| Compound Name: | 3-[(2-fluorophenyl)methyl]-2-(2-oxo-2H-1-benzopyran-3-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 458.51 |
| Molecular Formula: | C26 H19 F N2 O3 S |
| Smiles: | C1CCc2c(C1)c1C(N(Cc3ccccc3F)C(C3=Cc4ccccc4OC3=O)=Nc1s2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3596 |
| logD: | 5.3596 |
| logSw: | -5.6936 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.094 |
| InChI Key: | IVPZBRRGWWLBBG-UHFFFAOYSA-N |