2-{[(2-chlorophenyl)methyl]sulfanyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(2-chlorophenyl)methyl]sulfanyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
2-{[(2-chlorophenyl)methyl]sulfanyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | Y205-6488 |
| Compound Name: | 2-{[(2-chlorophenyl)methyl]sulfanyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 362.9 |
| Molecular Formula: | C17 H15 Cl N2 O S2 |
| Smiles: | C1CCc2c(C1)c1C(NC(=Nc1s2)SCc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.8505 |
| logD: | 4.8399 |
| logSw: | -5.1594 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.324 |
| InChI Key: | XIRASFKOVWUUIR-UHFFFAOYSA-N |