2-(benzylsulfanyl)-3-(3-methylphenyl)-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
2-(benzylsulfanyl)-3-(3-methylphenyl)-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
2-(benzylsulfanyl)-3-(3-methylphenyl)-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Compound characteristics
Compound ID: | 8640-0465 |
Compound Name: | 2-(benzylsulfanyl)-3-(3-methylphenyl)-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one |
Molecular Weight: | 462.63 |
Molecular Formula: | C26 H26 N2 O2 S2 |
Smiles: | CC(C)C1Cc2c3C(N(C(=Nc3sc2CO1)SCc1ccccc1)c1cccc(C)c1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 6.1626 |
logD: | 6.1626 |
logSw: | -5.4836 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 33.334 |
InChI Key: | WVPYUHOGNXATPU-OAQYLSRUSA-N |