3-benzyl-6-(propan-2-yl)-2-sulfanylidene-1,2,3,5,6,8-hexahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
3-benzyl-6-(propan-2-yl)-2-sulfanylidene-1,2,3,5,6,8-hexahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
3-benzyl-6-(propan-2-yl)-2-sulfanylidene-1,2,3,5,6,8-hexahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | 5627-0006 |
| Compound Name: | 3-benzyl-6-(propan-2-yl)-2-sulfanylidene-1,2,3,5,6,8-hexahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 372.51 |
| Molecular Formula: | C19 H20 N2 O2 S2 |
| Smiles: | CC(C)C1Cc2c3C(N(Cc4ccccc4)C(Nc3sc2CO1)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5375 |
| logD: | 4.4566 |
| logSw: | -4.4427 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.493 |
| InChI Key: | DTDGVQCCNJPUAD-CQSZACIVSA-N |