ethyl ({3-[(2-chlorophenyl)methyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)acetate
Chemical Structure Depiction of
ethyl ({3-[(2-chlorophenyl)methyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)acetate
ethyl ({3-[(2-chlorophenyl)methyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)acetate
Compound characteristics
| Compound ID: | K263-0758 |
| Compound Name: | ethyl ({3-[(2-chlorophenyl)methyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)acetate |
| Molecular Weight: | 444.96 |
| Molecular Formula: | C21 H17 Cl N2 O3 S2 |
| Smiles: | CCOC(CSC1=Nc2c3ccccc3sc2C(N1Cc1ccccc1[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2328 |
| logD: | 5.2328 |
| logSw: | -5.5948 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 44.696 |
| InChI Key: | MNRCWYBDHUVYTB-UHFFFAOYSA-N |