3-(2-methylphenyl)-2-(methylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-(2-methylphenyl)-2-(methylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
3-(2-methylphenyl)-2-(methylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | K843-0019 |
| Compound Name: | 3-(2-methylphenyl)-2-(methylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 342.48 |
| Molecular Formula: | C18 H18 N2 O S2 |
| Smiles: | Cc1ccccc1N1C(=Nc2c(C1=O)c1CCCCc1s2)SC |
| Stereo: | ACHIRAL |
| logP: | 4.5249 |
| logD: | 4.5249 |
| logSw: | -4.4684 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.953 |
| InChI Key: | SICPRVHCTIBRGK-UHFFFAOYSA-N |