3-(4-methylphenyl)-2-[(2-methylprop-2-en-1-yl)sulfanyl]-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
3-(4-methylphenyl)-2-[(2-methylprop-2-en-1-yl)sulfanyl]-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
3-(4-methylphenyl)-2-[(2-methylprop-2-en-1-yl)sulfanyl]-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: | 8640-0427 |
| Compound Name: | 3-(4-methylphenyl)-2-[(2-methylprop-2-en-1-yl)sulfanyl]-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 426.6 |
| Molecular Formula: | C23 H26 N2 O2 S2 |
| Smiles: | CC(C)C1Cc2c3C(N(C(=Nc3sc2CO1)SCC(C)=C)c1ccc(C)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0411 |
| logD: | 6.0411 |
| logSw: | -5.5017 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.606 |
| InChI Key: | JCQFDSHQQLOBFC-GOSISDBHSA-N |