2-(butylsulfanyl)-6,6-dimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
2-(butylsulfanyl)-6,6-dimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
2-(butylsulfanyl)-6,6-dimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | 8640-0107 |
| Compound Name: | 2-(butylsulfanyl)-6,6-dimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 324.46 |
| Molecular Formula: | C15 H20 N2 O2 S2 |
| Smiles: | [H]N1C(=Nc2c(C1=O)c1CC(C)(C)OCc1s2)SCCCC |
| Stereo: | ACHIRAL |
| logP: | 4.191 |
| logD: | 4.1646 |
| logSw: | -4.2758 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.292 |
| InChI Key: | BDFVQWVXFXSHRM-UHFFFAOYSA-N |