6,6,8-trimethyl-3-phenyl-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
6,6,8-trimethyl-3-phenyl-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
6,6,8-trimethyl-3-phenyl-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
Compound ID: | 8010-0254 |
Compound Name: | 6,6,8-trimethyl-3-phenyl-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
Molecular Weight: | 356.51 |
Molecular Formula: | C19 H20 N2 O S2 |
Smiles: | CC1CC(C)(C)Cc2c3C(N(C(=Nc3sc12)S)c1ccccc1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.3524 |
logD: | -0.6768 |
logSw: | -4.5483 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 24.7602 |
InChI Key: | FIESIEPUEWAAHT-NSHDSACASA-N |