3,6,6-trimethyl-2-(methylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
3,6,6-trimethyl-2-(methylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
3,6,6-trimethyl-2-(methylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | 3683-0321 |
| Compound Name: | 3,6,6-trimethyl-2-(methylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 296.41 |
| Molecular Formula: | C13 H16 N2 O2 S2 |
| Smiles: | CC1(C)Cc2c3C(N(C)C(=Nc3sc2CO1)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5632 |
| logD: | 2.5632 |
| logSw: | -2.1844 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.6 |
| InChI Key: | ZJAVBVSACKEJFD-UHFFFAOYSA-N |