3-[(2-chlorophenyl)methyl]-2-(methylsulfanyl)[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-[(2-chlorophenyl)methyl]-2-(methylsulfanyl)[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
3-[(2-chlorophenyl)methyl]-2-(methylsulfanyl)[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | K263-0760 |
| Compound Name: | 3-[(2-chlorophenyl)methyl]-2-(methylsulfanyl)[1]benzothieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 372.89 |
| Molecular Formula: | C18 H13 Cl N2 O S2 |
| Smiles: | CSC1=Nc2c3ccccc3sc2C(N1Cc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.0961 |
| logD: | 5.0961 |
| logSw: | -5.3375 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.5373 |
| InChI Key: | PBSUBJWBEWLDJI-UHFFFAOYSA-N |