3,7-dimethyl-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3,7-dimethyl-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
3,7-dimethyl-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 8010-2831 |
| Compound Name: | 3,7-dimethyl-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 266.38 |
| Molecular Formula: | C12 H14 N2 O S2 |
| Smiles: | CC1CCc2c3C(N(C)C(=Nc3sc2C1)S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8243 |
| logD: | -1.1896 |
| logSw: | -3.1683 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 25.4089 |
| InChI Key: | BFMZVAGSDKNEJI-ZCFIWIBFSA-N |