Propanedioic acid,2-[(2-nitrophenyl)methylene]-, 1,3-dimethyl ester

• 常用名: Propanedioic acid,2-[(2-nitrophenyl)methylene]-, 1,3-dimethyl ester
• 英文名: Propanedioic acid,2-[(2-nitrophenyl)methylene]-, 1,3-dimethyl ester
• CAS号: 65974-52-9
• 分子量: 265.21900
• 密度: 1.335g/cm3
• 沸点: 361.7ºC at 760mmHg
• 分子式: C₁₂H₁₁NO₆
• 熔点: N/A
• 闪点: 151.8ºC

用途

NCI126224 是一种 TLR4 信号传导抑制剂。NCI126224 在纳摩尔至低微摩尔范围内抑制 LPS (HY-D1056) 诱导的 NF-κB、TNF-α、IL-1β 和 NO 的产生。NCI126224 可用于炎症性疾病的研究。

名称

• 英文名: dimethyl 2-[(2-nitrophenyl)methylidene]propanedioate

生物活性

• 描述: NCI126224 是一种 TLR4 信号传导抑制剂。NCI126224 在纳摩尔至低微摩尔范围内抑制 LPS (HY-D1056) 诱导的 NF-κB、TNF-α、IL-1β 和 NO 的产生。NCI126224 可用于炎症性疾病的研究。
• 相关类别:
  信号通路 >> 免疫及炎症 >> Toll样受体(TLR)
  研究领域 >> 炎症/免疫
• 参考文献:

  [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.

物理化学性质

• 密度: 1.335g/cm3
• 沸点: 361.7ºC at 760mmHg
• 分子式: C₁₂H₁₁NO₆
• 分子量: 265.21900
• 闪点: 151.8ºC
• 精确质量: 265.05900
• PSA: 98.42000
• LogP: 1.84740
• InChIKey: LKLMASCOTOBEMT-UHFFFAOYSA-N
• SMILES: COC(=O)C(=Cc1ccccc1[N+](=O)[O-])C(=O)OC
• 折射率: 1.578

靶点实验

查看更多实验

实验名称：Primary cell-based high-throughput screening assay for identification of compounds th... 来源：Johns Hopkins Ion Channel Center 靶标：regulator of G-protein signaling 4 isoform 2 [Homo sapiens] External Id：JHICC_RGS_Act_HTS

实验名称：Luminescence-based cell-based primary high throughput screening assay to identify ago... 来源：The Scripps Research Institute Molecular Screening Center 靶标：mu-type opioid receptor isoform MOR-1 [Homo sapiens] External Id：OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN

实验名称：QFRET-based biochemical primary high throughput screening assay to identify exosite i... 来源：The Scripps Research Institute Molecular Screening Center 靶标：disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens] External Id：ADAM17_INH_QFRET_1536_1X%INH PRUN

实验名称：Fluorescence-based cell-based primary high throughput screening assay to identify ago... 来源：The Scripps Research Institute Molecular Screening Center 靶标：muscarinic acetylcholine receptor M1 [Homo sapiens] External Id：CHRM1_AG_FLUO8_1536_1X%ACT PRUN

实验名称：uHTS identification of small molecule activators of the adaptive arm of the Unfolded ... 来源：Burnham Center for Chemical Genomics 靶标：N/A External Id：BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay

实验名称：Antibacterial activity against Klebsiella pneumoniae MDR ATCC 70063 (CO-ADD:GN_003); ... 来源：ChEMBL 靶标：Klebsiella pneumoniae External Id：CHEMBL4296186

实验名称：HCS to Identify Inhibitors of Dynein Mediated Cargo Transport on Microtubules: Confir... 来源：University of Pittsburgh Molecular Library Screening Center 靶标：N/A External Id：HCS to Identify Inhibitors of Dynein Mediated Cargo Transport on Microtubules: Confirmation Assay, R21NS057026

实验名称：High throughput fluorescence intensity-based biochemical assay to screen for small mo... 来源：University of Pittsburgh Molecular Library Screening Center 靶标：furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens] External Id：MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.

实验名称：Fluorescence polarization to screen for inhibitor that competite the binding of FadD2... 来源：Broad Institute 靶标：FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE) External Id：2147-01_Inhibitor_SinglePoint_HTS_Activity

实验名称：Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect... 来源：Broad Institute 靶标：N/A External Id：Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity

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英文别名

• HMS2882B21
• 2'-nitrobenzylidenemalonic acid dimethyl ester
• dimethyl 2-nitrobenzylidenemalonate
• ortho-nitrobenzylidenmalonsaeuredimethylester