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ChemicalBook--->CAS DataBase List--->851941-94-1

851941-94-1

851941-94-1 Structure

851941-94-1 Structure
IdentificationBack Directory
[Name]

8-((4-(furan-2-carbonyl)piperazin-1-yl)methyl)-7-isopentyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
[CAS]

851941-94-1
[Synonyms]

CM026
CM-026
CM 026
8-((4-(furan-2-carbonyl)piperazin-1-yl)methyl)-7-isopentyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
1H-Purine-2,6-dione, 8-[[4-(2-furanylcarbonyl)-1-piperazinyl]methyl]-3,7-dihydro-1,3-dimethyl-7-(3-methylbutyl)-
[Molecular Formula]

C22H30N6O4
[MOL File]

851941-94-1.mol
[Molecular Weight]

442.51
Chemical PropertiesBack Directory
[Boiling point ]

636.3±65.0 °C(Predicted)
[density ]

1.35±0.1 g/cm3(Predicted)
[pka]

5.14±0.10(Predicted)
Hazard InformationBack Directory
[Uses]

CM026 is a selective aldehyde dehydrogenase 1A1 inhibitor with submicromolar inhibitory activity against aldehyde dehydrogenase 1A1. Its inhibitory mechanism is related to binding to the aldehyde binding pocket and utilizing a unique glycine residue. It can be used as a chemical tool to study the role of this enzyme in disease.
[References]

[1] Design, synthesis of 1,3-dimethylpyrimidine-2,4-diones as potent and selective aldehyde dehydrogenase 1A1 (ALDH1A1) inhibitors with glucose consumption improving activity DOI:10.1016/j.bioorg.2020.103971
[2] Characterization of two distinct structural classes of selective aldehyde dehydrogenase 1A1 inhibitors
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