6,6-dimethyl-2-(methylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
6,6-dimethyl-2-(methylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
6,6-dimethyl-2-(methylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | 8004-2159 |
| Compound Name: | 6,6-dimethyl-2-(methylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 282.38 |
| Molecular Formula: | C12 H14 N2 O2 S2 |
| Smiles: | CC1(C)Cc2c3C(NC(=Nc3sc2CO1)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6482 |
| logD: | 2.5778 |
| logSw: | -2.8679 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.292 |
| InChI Key: | NAJSMHGCAMZELH-UHFFFAOYSA-N |