3-benzyl-2-[(2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-benzyl-2-[(2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
3-benzyl-2-[(2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 4333-3477 |
| Compound Name: | 3-benzyl-2-[(2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 432.61 |
| Molecular Formula: | C25 H24 N2 O S2 |
| Smiles: | C1CCc2c(C1)c1C(N(Cc3ccccc3)C(=Nc1s2)SCCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5128 |
| logD: | 6.5128 |
| logSw: | -5.9771 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 25.5939 |
| InChI Key: | KAWBACSMOIWKBT-UHFFFAOYSA-N |