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2761321-26-8

2761321-26-8 Structure

2761321-26-8 Structure
IdentificationBack Directory
[Name]

1H-Purine-2,6-dione, 8-bromo-1,7-bis[(4-bromophenyl)methyl]-3,7-dihydro-3-methyl-
[CAS]

2761321-26-8
[Synonyms]

BRD4-BD1-IN-2
1H-Purine-2,6-dione, 8-bromo-1,7-bis[(4-bromophenyl)methyl]-3,7-dihydro-3-methyl-
[Molecular Formula]

C20H15Br3N4O2
[MOL File]

2761321-26-8.mol
[Molecular Weight]

583.07
Chemical PropertiesBack Directory
[Boiling point ]

706.6±70.0 °C(Predicted)
[density ]

1.88±0.1 g/cm3(Predicted)
[pka]

-2.98±0.20(Predicted)
Hazard InformationBack Directory
[Uses]

BRD4-BD1-IN-2 is a selective BRD4-BD1 inhibitor, with an IC50 of 2.51 μM (20-times greater than that of BD2). BRD4-BD1-IN-2 can be used in studies of cancer and cardiovascular diseases[1].
[IC 50]

BRD4-BD1: 2.51 μM (IC50); BRD4-BD2: >50 μM (IC50)
[References]

[1] Chang Y, et al. Design, synthesis, biological evaluation, and molecular docking of 1, 7-dibenzyl-substituted theophylline derivatives as novel BRD4-BD1-selective inhibitors. Medicinal Chemistry Research, 2021, 30(8): 1453-1468.
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