3-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
3-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | K292-0752 |
| Compound Name: | 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 550.7 |
| Molecular Formula: | C28 H30 N4 O4 S2 |
| Smiles: | COc1ccc(CCN2C(=Nc3ccsc3C2=O)SCC(N2CCN(CC2)c2ccccc2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.901 |
| logD: | 3.901 |
| logSw: | -3.9668 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.681 |
| InChI Key: | CCFIQQBFNKLGOI-UHFFFAOYSA-N |