3-氰基-4-苯基-6-(3-溴-6-羟基苯基)-2(1H)-吡啶酮

• 常用名: 3-氰基-4-苯基-6-(3-溴-6-羟基苯基)-2(1H)-吡啶酮
• 英文名: TCS PIM-1 1
• CAS号: 491871-58-0
• 分子量: 367.196
• 密度: 1.6±0.1 g/cm3
• 沸点: 592.6±50.0 °C at 760 mmHg
• 分子式: C₁₈H₁₁BrN₂O₂
• 熔点: N/A
• 闪点: 312.2±30.1 °C

用途

TCS PIM-1 1(sc-204330)是ATP竞争性Pim-1激酶抑制剂,IC50为50nM,比对Pim-2和MEK1/MEK2的抑制性较高。

名称

• 中文名: 3-氰基-4-苯基-6-(3-溴-6-羟基苯基)-2(1H)-吡啶酮
• 英文名: 6-(5-Bromo-2-hydroxyphenyl)-2-oxo-4-phenyl-1,2-dihydro-3-pyridine carbonitrile

生物活性

• 描述: TCS PIM-1 1(sc-204330)是ATP竞争性Pim-1激酶抑制剂,IC50为50nM,比对Pim-2和MEK1/MEK2的抑制性较高。
• 相关类别:
  信号通路 >> JAK/STAT信号通路 >> 皮姆
  研究领域 >> 癌症
• 参考文献:

  [1]. Cheney IW, et al. Identification and structure-activity relationships of substituted pyridones as inhibitors of Pim-1 kinase. Bioorg Med Chem Lett. 2007 Mar 15;17(6):1679-83.

  [2]. Shen Y, et al. Pim-1 inhibitor attenuates trinitrobenzene sulphonic acid induced colitis in the mice. Clin Res Hepatol Gastroenterol. 2018 Sep;42(4):382-386.

物理化学性质

• 密度: 1.6±0.1 g/cm3
• 沸点: 592.6±50.0 °C at 760 mmHg
• 分子式: C₁₈H₁₁BrN₂O₂
• 分子量: 367.196
• 闪点: 312.2±30.1 °C
• 精确质量: 366.000397
• PSA: 77.14000
• LogP: 4.60
• InChIKey: SVSYJTYGPLVUOZ-UHFFFAOYSA-N
• SMILES: N#Cc1c(-c2ccccc2)cc(-c2cc(Br)ccc2O)[nH]c1=O
• 蒸汽压: 0.0±1.7 mmHg at 25°C
• 折射率: 1.728
• 储存条件: 2-8℃

靶点实验

查看更多实验

实验名称：Radioactive Filter Plate Assay from Article 10.1016/j.bmcl.2006.12.086: "Identificati... 来源：BindingDB 靶标：N/A External Id：BindingDB_2991_1

实验名称：Enzymatic assay of human HDAC6 with commercial peptide substrate 来源：ChEMBL 靶标：Histone deacetylase 6 External Id：CHEMBL4808149

实验名称：Discovery of Small Molecules to Inhibit Human Cytomegalovirus Nuclear Egress 来源：ICCB-Longwood/NSRB Screening Facility, Harvard Medical School 靶标：HCMV UL50 External Id：HMS1262

实验名称：Inhibition of Pim1 kinase 来源：ChEMBL 靶标：Serine/threonine-protein kinase pim-1 External Id：CHEMBL903376

实验名称：Enzymatic assay of human HDAC6 with custom peptide substrate 来源：ChEMBL 靶标：Histone deacetylase 6 External Id：CHEMBL4808150

实验名称：Inhibition of Pim1 assessed as [32P] incorporation preincubated for 15 mins before AT... 来源：ChEMBL 靶标：Serine/threonine-protein kinase pim-1 External Id：CHEMBL1022925

实验名称：Experimentally measured binding affinity data (IC50) for protein-ligand complexes der... 来源：Shanghai Institute of Organic Chemistry 靶标：N/A External Id：PDBbind-IC50 for protein-ligand complexes

实验名称：Antiviral activity determined as inhibition of SARS-CoV-2 induced cytotoxicity of VER... 来源：ChEMBL 靶标：Severe acute respiratory syndrome coronavirus 2 External Id：CHEMBL4513082

实验名称：A screen for small molecules that modulate mitochondrial supercomplex formation 来源：ICCB-Longwood/NSRB Screening Facility, Harvard Medical School 靶标：N/A External Id：HMS1482

实验名称：Antiviral activity determined as inhibition of SARS-CoV-2 induced cytotoxicity of Cac... 来源：ChEMBL 靶标：Severe acute respiratory syndrome coronavirus 2 External Id：CHEMBL4303805

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英文别名

• 2-oxo-4-phenyl-5H-furan-3-carbonitrile
• 6-(5-Bromo-2-hydroxyphenyl)-2-oxo-4-phenyl-1,2-dihydropyridine-3-carbonitrile
• TCS PIM-1 1
• 3-cyano-4-phenyl-2(5H)-furanone
• 3-Cyano-4-phenyl-2(5H)-furanon
• 3-Cyan-4-phenyl-2(5H)-furanon
• 2-oxo-4-phenyl-2,5-dihydro-furan-3-carbonitrile
• 2-oxo-4-phenyl-2,5-dihydro-3-furancarbonitrile
• 3-cyano-4-phenyl-6-(3-bromo-6-hydroxyphenyl)-2-pyridone
• 3-cyano-4-phenyl-6-(3-bromo-6-hydroxy)phenyl-2(1H)-pyridone
• 6-(5-Bromo-2-hydroxyphenyl)-2-oxo-4-phenyl-1,2-dihydro-3-pyridinecarbonitrile