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65974-52-9

65974-52-9 structure
65974-52-9 structure

Name dimethyl 2-[(2-nitrophenyl)methylidene]propanedioate
Synonyms HMS2882B21
2'-nitrobenzylidenemalonic acid dimethyl ester
dimethyl 2-nitrobenzylidenemalonate
ortho-nitrobenzylidenmalonsaeuredimethylester
Description NCI126224 is a TLR4 signaling inhibitor. NCI126224 suppress LPS (HY-D1056)-induced production of NF-κB, TNF-α, IL-1β, and NO in the nanomolar-low micromolar range. NCI126224 can be used for the research of inflammatory diseases[1].
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References

[1]. Zhang S, et, al. Selection, synthesis, and anti-inflammatory evaluation of the arylidene malonate derivatives as TLR4 signaling inhibitors. Bioorg Med Chem. 2012 Oct 15;20(20):6073-9.  

Density 1.335g/cm3
Boiling Point 361.7ºC at 760mmHg
Molecular Formula C12H11NO6
Molecular Weight 265.21900
Flash Point 151.8ºC
Exact Mass 265.05900
PSA 98.42000
LogP 1.84740
Index of Refraction 1.578

~97%

65974-52-9 structure

65974-52-9

Literature: Zhao, Xue Zhi; Smith, Steven J.; Metifiot, Mathieu; Johnson, Barry C.; Marchand, Christophe; Pommier, Yves; Hughes, Stephen H.; Burke Jr., Terrence R. Journal of Medicinal Chemistry, 2014 , vol. 57, # 4 p. 1573 - 1582

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65974-52-9 structure

65974-52-9

Literature: Takeda Chemical Industries, Ltd. Patent: US6329389 B1, 2001 ;