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2637243-08-2

2637243-08-2 Structure

2637243-08-2 Structure
IdentificationBack Directory
[Name]

(R)-Benpyrine
[CAS]

2637243-08-2
[Synonyms]

(R)-Benpyrine
[Molecular Formula]

C16H16N6O
[MOL File]

2637243-08-2.mol
[Molecular Weight]

308.34
Chemical PropertiesBack Directory
[Boiling point ]

699.1±55.0 °C(predicted)
[density ]

1.456±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)
[form ]

Solid
[pka]

10.01±0.10(predicted)
[color ]

Off-white to light yellow
Hazard InformationBack Directory
[Uses]

(R)-Benpyrine is the isomer of Benpyrine (HY-133807), and can be used as an experimental control. Benpyrine is a highly specific and orally active TNF-α inhibitor with a KD value of 82.1 μM. Benpyrine tightly binds to TNF-α and blocks its interaction with TNFR1, with an IC50 value of 0.109 μM. Benpyrine has the potential for TNF-α mediated inflammatory and autoimmune disease research[1].
[References]

[1] Weiguang Sun, et al. Discovery of an Orally Active Small Molecule TNF-α Inhibitor. J Med Chem. 2020 Jul 15. DOI:10.1021/acs.jmedchem.0c00377
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