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98991-32-3

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98991-32-3 Structure

98991-32-3 Structure
IdentificationBack Directory
[Name]

2-Propen-1-one, 1-(4-bromophenyl)-3-(4-fluorophenyl)-
[CAS]

98991-32-3
[Synonyms]

CHBO4
1-(4-bromophenyl)-3-(4-fluorophenyl)prop-2-en-1-one
2-Propen-1-one, 1-(4-bromophenyl)-3-(4-fluorophenyl)-
(2E)-1-(4-bromophenyl)-3-(4-fluorophenyl)prop-2-en-1-one
[Molecular Formula]

C15H10BrFO
[MDL Number]

MFCD00446111
[MOL File]

98991-32-3.mol
[Molecular Weight]

305.14
Chemical PropertiesBack Directory
[Melting point ]

133～135℃
[Boiling point ]

400.6±45.0 °C(Predicted)
[density ]

1.451±0.06 g/cm3(Predicted)
Hazard InformationBack Directory
[Uses]

CHBO4 is a potent, reversible, competitive, and selective hMAO-B inhibitor with an IC50 value of 0.031 μM in CHBO subseries and an Ki value of 0.010 ± 0.005 μM. CHBO4 reduce cell damage by scavenging intracellular reactive oxygen species (ROS). CHBO4 can be used for Parkinson's Disease (PD) research[1].
[IC 50]

hMAO-B: 0.031 μM (IC50); hMAO-B: 0.010 μM (Ki)
[References]

[1] Thomas Parambi DG, et al. Halogenated class of oximes as a new class of monoamine oxidase-B inhibitors for the treatment of Parkinson's disease: Synthesis, biochemistry, and molecular dynamics study. Comput Biol Chem. 2023 Aug;105:107899. DOI:10.1016/j.compbiolchem.2023.107899
Spectrum DetailBack Directory
[Spectrum Detail]

2-Propen-1-one, 1-(4-bromophenyl)-3-(4-fluorophenyl)-(98991-32-3)1HNMR
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