2-{[(8-hydroxyquinolin-5-yl)methyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(8-hydroxyquinolin-5-yl)methyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
2-{[(8-hydroxyquinolin-5-yl)methyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 8015-4203 |
| Compound Name: | 2-{[(8-hydroxyquinolin-5-yl)methyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 471.6 |
| Molecular Formula: | C26 H21 N3 O2 S2 |
| Smiles: | C1CCc2c(C1)c1C(N(C(=Nc1s2)SCc1ccc(c2c1cccn2)O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.499 |
| logD: | 5.4873 |
| logSw: | -5.5702 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.064 |
| InChI Key: | HZRVZPFDBZLZJC-UHFFFAOYSA-N |