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2742707-47-5

2742707-47-5 Structure

2742707-47-5 Structure
IdentificationBack Directory
[Name]

1H-1,2,3-Triazole, 4-[[[3,4-dihydro-5-methoxy-2-(3,4,5-trimethoxyphenyl)-2H-1-benzopyran-7-yl]oxy]methyl]-1-[[4-(trifluoromethyl)phenyl]methyl]-
[CAS]

2742707-47-5
[Synonyms]

AChE/BuChE-IN-3
1H-1,2,3-Triazole, 4-[[[3,4-dihydro-5-methoxy-2-(3,4,5-trimethoxyphenyl)-2H-1-benzopyran-7-yl]oxy]methyl]-1-[[4-(trifluoromethyl)phenyl]methyl]-
[Molecular Formula]

C30H30F3N3O6
[MOL File]

2742707-47-5.mol
[Molecular Weight]

585.57
Chemical PropertiesBack Directory
[Boiling point ]

699.6±65.0 °C(Predicted)
[density ]

1.32±0.1 g/cm3(Predicted)
[pka]

0.15±0.10(Predicted)
Hazard InformationBack Directory
[Uses]

AChE/BuChE-IN-3 is a potent and blood-brain barrier (BBB) penetrant AChE and BuChE dual inhibitor with IC50s of 0.65 μM and 5.77 μM for AChE and BuChE. AChE/BuChE-IN-3 also inhibits Aβ1-42 aggregation. AChE/BuChE-IN-3 has effectively neuroprotective activities and nearly no toxicity on SH-SY5Y cells. AChE/BuChE-IN-3 can be used for researching Alzheimer's disease[1].
[IC 50]

AChE: 0.65 μM (IC50); BChE: 5.77 μM (IC50)
[References]

[1] Shi S, et al. Semi-synthesis and biological evaluation of flavone hybrids as multifunctional agents for the potential treatment of Alzheimer's disease. Bioorg Chem. 2020 Jul;100:103917. DOI:10.1016/j.bioorg.2020.103917
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