ethyl ({3-[(4-methylphenyl)methyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)acetate
Chemical Structure Depiction of
ethyl ({3-[(4-methylphenyl)methyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)acetate
ethyl ({3-[(4-methylphenyl)methyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)acetate
Compound characteristics
| Compound ID: | K263-0081 |
| Compound Name: | ethyl ({3-[(4-methylphenyl)methyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)acetate |
| Molecular Weight: | 424.54 |
| Molecular Formula: | C22 H20 N2 O3 S2 |
| Smiles: | CCOC(CSC1=Nc2c3ccccc3sc2C(N1Cc1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1723 |
| logD: | 5.1723 |
| logSw: | -5.0398 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 44.696 |
| InChI Key: | UZLAFJHLDXFGLQ-UHFFFAOYSA-N |