3-[(oxolan-2-yl)methyl]-2-[(2-oxo-2-phenylethyl)sulfanyl][1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-[(oxolan-2-yl)methyl]-2-[(2-oxo-2-phenylethyl)sulfanyl][1]benzothieno[3,2-d]pyrimidin-4(3H)-one
3-[(oxolan-2-yl)methyl]-2-[(2-oxo-2-phenylethyl)sulfanyl][1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | K263-0712 |
| Compound Name: | 3-[(oxolan-2-yl)methyl]-2-[(2-oxo-2-phenylethyl)sulfanyl][1]benzothieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 436.55 |
| Molecular Formula: | C23 H20 N2 O3 S2 |
| Smiles: | C1CC(CN2C(=Nc3c4ccccc4sc3C2=O)SCC(c2ccccc2)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0027 |
| logD: | 4.0027 |
| logSw: | -4.2027 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.167 |
| InChI Key: | GRCSJOZJBZMRRZ-MRXNPFEDSA-N |