2-{[(2-chlorophenyl)methyl]sulfanyl}-3-[2-(3,4-dimethoxyphenyl)ethyl]thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(2-chlorophenyl)methyl]sulfanyl}-3-[2-(3,4-dimethoxyphenyl)ethyl]thieno[3,2-d]pyrimidin-4(3H)-one
2-{[(2-chlorophenyl)methyl]sulfanyl}-3-[2-(3,4-dimethoxyphenyl)ethyl]thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
Compound ID: | K292-0716 |
Compound Name: | 2-{[(2-chlorophenyl)methyl]sulfanyl}-3-[2-(3,4-dimethoxyphenyl)ethyl]thieno[3,2-d]pyrimidin-4(3H)-one |
Molecular Weight: | 473.01 |
Molecular Formula: | C23 H21 Cl N2 O3 S2 |
Smiles: | COc1ccc(CCN2C(=Nc3ccsc3C2=O)SCc2ccccc2[Cl])cc1OC |
Stereo: | ACHIRAL |
logP: | 5.2637 |
logD: | 5.2637 |
logSw: | -5.7682 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 42.029 |
InChI Key: | VMDTYURYDNZAIN-UHFFFAOYSA-N |