2-[5-(3-chloro-4-fluorophenyl)furan-2-yl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-[5-(3-chloro-4-fluorophenyl)furan-2-yl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
2-[5-(3-chloro-4-fluorophenyl)furan-2-yl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 3810-0139 |
| Compound Name: | 2-[5-(3-chloro-4-fluorophenyl)furan-2-yl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 400.86 |
| Molecular Formula: | C20 H14 Cl F N2 O2 S |
| Smiles: | C1CCc2c(C1)c1C(NC(c3ccc(c4ccc(c(c4)[Cl])F)o3)=Nc1s2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2049 |
| logD: | 5.2 |
| logSw: | -6.1518 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.113 |
| InChI Key: | ZJTANBLTPASQAS-UHFFFAOYSA-N |