3-[(4-methoxyphenyl)methyl]-2-[(2-oxo-2-phenylethyl)sulfanyl][1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-[(4-methoxyphenyl)methyl]-2-[(2-oxo-2-phenylethyl)sulfanyl][1]benzothieno[3,2-d]pyrimidin-4(3H)-one
3-[(4-methoxyphenyl)methyl]-2-[(2-oxo-2-phenylethyl)sulfanyl][1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | K263-0017 |
| Compound Name: | 3-[(4-methoxyphenyl)methyl]-2-[(2-oxo-2-phenylethyl)sulfanyl][1]benzothieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 472.58 |
| Molecular Formula: | C26 H20 N2 O3 S2 |
| Smiles: | COc1ccc(CN2C(=Nc3c4ccccc4sc3C2=O)SCC(c2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.5423 |
| logD: | 5.5423 |
| logSw: | -5.7431 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.056 |
| InChI Key: | VSGPEADGBXMBSD-UHFFFAOYSA-N |