[(6,6-dimethyl-4-oxo-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetonitrile
Chemical Structure Depiction of
[(6,6-dimethyl-4-oxo-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetonitrile
[(6,6-dimethyl-4-oxo-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetonitrile
Compound characteristics
| Compound ID: | 8640-0467 |
| Compound Name: | [(6,6-dimethyl-4-oxo-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetonitrile |
| Molecular Weight: | 383.49 |
| Molecular Formula: | C19 H17 N3 O2 S2 |
| Smiles: | CC1(C)Cc2c3C(N(C(=Nc3sc2CO1)SCC#N)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3329 |
| logD: | 3.3329 |
| logSw: | -3.6777 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.443 |
| InChI Key: | MHIKZSJZGMJXTL-UHFFFAOYSA-N |