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854137-39-6

854137-39-6 Structure

854137-39-6 Structure
IdentificationBack Directory
[Name]

WAY-652291
[CAS]

854137-39-6
[Synonyms]

WAY-652291
BETbromodomaininhibitor3
1,3-Dimethyl-5-(p-tolyl)-5,9-dihydrofuro[3',4':5,6]pyrido[2,3-d]pyrimidine-2,4,6(1H,3H,8H)-trione
1,3-dimethyl-5-(p-tolyl)-8,9-dihydrofuro[3',4':5,6]pyrido[2,3-d]pyrimidine-2,4,6(1H,3H,5H)-trione
1,3-Dimethyl-5-(p-tolyl)-5,9-dihydrofuro[3',4':5,6]pyrido[2,3-d]pyrimidine-2,4,6(1H,3H,8H)-trione
1,3-dimethyl-5-(p-tolyl)-8,9-dihydrofuro[3',4':5,6]pyrido[2,3-d]pyrimidine-2,4,6(1H,3H,5H)-trione
[Molecular Formula]

C18H17N3O4
[MOL File]

854137-39-6.mol
[Molecular Weight]

339.35
Chemical PropertiesBack Directory
[Melting point ]

294-296 °C (decomp)
[Boiling point ]

570.664±60.00 °C(Press: 760.00 Torr)(predicted)
[density ]

1.450±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
[form ]

Solid
[pka]

1.351±0.40(predicted)
[color ]

White to off-white
Hazard InformationBack Directory
[Uses]

BET bromodomain inhibitor 3 is BET bromodomain inhibitor. BET bromodomain inhibitor 3 has inhibitory effect against BrdT with Ki value of > 40 μM. BET bromodomain inhibitor 3 can be used for the research of contraception, cancer, and heart disease[1].
[References]

[1] Ayoub AM, et al. BET Bromodomain Inhibitors with One-Step Synthesis Discovered from Virtual Screen [published correction appears in J Med Chem. 2017 Jul 27;60(14):6458]. J Med Chem. 2017;60(12):4805-4817. DOI:10.1021/acs.jmedchem.6b01336
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