2-[(2-methylprop-2-en-1-yl)sulfanyl]-3-phenyl-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-[(2-methylprop-2-en-1-yl)sulfanyl]-3-phenyl-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
2-[(2-methylprop-2-en-1-yl)sulfanyl]-3-phenyl-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: | 4149-0242 |
| Compound Name: | 2-[(2-methylprop-2-en-1-yl)sulfanyl]-3-phenyl-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 412.57 |
| Molecular Formula: | C22 H24 N2 O2 S2 |
| Smiles: | CC(C)C1Cc2c3C(N(C(=Nc3sc2CO1)SCC(C)=C)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4961 |
| logD: | 5.4961 |
| logSw: | -5.4957 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.606 |
| InChI Key: | ZWJJLIPCYDQSEP-QGZVFWFLSA-N |