1-(2-chloropyridin-5-yl)-3-dimethylamino-2-propen-1-one | 879373-79-2

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 1-(2-chloropyridin-5-yl)-3-dimethylamino-2-propen-1-one
• 英文别名: 3-dimethylamino-1-(2-chloro-5-pyridyl)-2-propen-1-one；1-(2-chloropyrid-5-yl)-3-dimethylamino-2-propen-1-one；1-(6-chloropyridin-3-yl)-3-(dimethylamino)-2-propen-1-one；(2E)-1-(6-chloropyridine-3-yl)-3-(dimethylamino)prop-2-en-1-one；(E)-1-(6-Chloropyridin-3-yl)-3-(dimethylamino)prop-2-en-1-one
• CAS: 879373-79-2
• 化学式: C₁₀H₁₁ClN₂O
• 分子量: 210.663
• InChiKey: SDEUVPIWIXBTTL-AATRIKPKSA-N

物化性质

• 沸点：
  326.3±42.0 °C(Predicted)
• 密度：
  1.193±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.9
• 重原子数：
  14
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  33.2
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  1-(2-chloropyridin-5-yl)-3-dimethylamino-2-propen-1-one 在 sodium hydroxide 作用下， 以 异丙醇 为溶剂， 生成 (S)-4-(6-(3-methylpiperazin-1-yl)pyridin-3-yl)-N-(3,4,5-trimethoxyphenyl)pyrimidin-2-amine
  参考文献：
  名称：

  4-Pyridin-5-yl-2-(3,4,5-trimethoxyphenylamino)pyrimidines: Potent and selective inhibitors of ZAP 70

  摘要：

  Activation of the tyrosine kinase ZAP 70 has been shown to be crucial to the transduction of the T-cell receptor signalling pathway, which leads ultimately to proliferation, cytokine gene expression and T-cell effector functions. A series of 2-phenylaminopyrimidines have been identified as potent and selective inhibitors of ZAP 70(1) (C) 1999 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(99)00615-0
• 作为产物：
  描述：

  2-氯-5-乙酰基吡啶 、 N,N-二甲基甲酰胺二乙基缩醛 生成 1-(2-chloropyridin-5-yl)-3-dimethylamino-2-propen-1-one
  参考文献：
  名称：

  4-Pyridin-5-yl-2-(3,4,5-trimethoxyphenylamino)pyrimidines: Potent and selective inhibitors of ZAP 70

  摘要：

  Activation of the tyrosine kinase ZAP 70 has been shown to be crucial to the transduction of the T-cell receptor signalling pathway, which leads ultimately to proliferation, cytokine gene expression and T-cell effector functions. A series of 2-phenylaminopyrimidines have been identified as potent and selective inhibitors of ZAP 70(1) (C) 1999 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(99)00615-0

文献信息

• Method of using substituted pyrazolo [1,5-a] pyrimidines
  申请人：Wang Daniel Yanong

  公开号：US20060063784A1

  公开（公告）日：2006-03-23

  This invention relates to novel methods of use of certain pyrazolo[1,5-a]pyrimidine compounds and the therapeutically acceptable salts thereof. This invention also relates to novel methods of using these compounds as anti-proliferative agents in mammals, including humans.

  这项发明涉及某些吡唑并[1,5-a]嘧啶化合物及其治疗上可接受的盐的新用途方法。该发明还涉及将这些化合物作为抗增殖剂在哺乳动物，包括人类中的新用途方法。
• Substituted pyrazolo[1,5-a] pyrimidines and process for making same
  申请人：Wang Daniel Yanong

  公开号：US20060063785A1

  公开（公告）日：2006-03-23

  This invention relates to novel pyrazolo[1,5-a]pyrimidine compounds and the therapeutically acceptable salts thereof. These compounds are useful as anti-proliferative agents in mammals, including humans.

  这项发明涉及新型吡唑并[1,5-a]嘧啶化合物及其治疗上可接受的盐。这些化合物在哺乳动物，包括人类中作为抗增殖剂是有用的。
• [EN] PYRIMIDINE-2-AMINE COMPOUNDS AND THEIR USE AS INHIBITORS OF JAK KINASES<br/>[FR] COMPOSÉS DE PYRIMIDINE-2-AMINE ET LEUR UTILISATION EN TANT QU'INHIBITEURS DES KINASES JAK
  申请人：RIGEL PHARMACEUTICALS INC

  公开号：WO2009103032A1

  公开（公告）日：2009-08-20

  This invention is directed to compounds of formula (I): where, n, m, Y, R1, R2, R3, R4 and R5 are disclosed herein, as isolated stereoisomers or mixtures thereof, or as pharmaceutically acceptable salts thereof; pharmaceutical compositions comprising the compounds of formula (I); and methods of using the compounds and the pharmaceutical compositions in treating diseases or conditions associated with JAK2 activity.

  这项发明涉及式(I)的化合物：其中，n、m、Y、R1、R2、R3、R4和R5如本文所披露，作为分离的立体异构体或其混合物，或其药学上可接受的盐；包括式(I)化合物的药物组合物；以及使用这些化合物和药物组合物治疗与JAK2活性相关的疾病或症状的方法。
• [EN] PYRONE COMPOUND AND ITS USE FOR PEST CONTROL<br/>[FR] COMPOSÉ DE PYRONE ET SON UTILISATION POUR LUTTER CONTRE LES ORGANISMES NUISIBLES
  申请人：SUMITOMO CHEMICAL CO

  公开号：WO2011049150A1

  公开（公告）日：2011-04-28

  A pyrone compound represented by formula (1) has an excellent controlling effect on pests. Since the compound of formula (1) has a controlling activity on pests, the compound is useful as an active ingredient of a pest control agent.

  由公式（1）表示的吡喁化合物对害虫有出色的控制效果。由于公式（1）的化合物对害虫具有控制活性，因此该化合物可用作杀虫剂的活性成分。
• Compounds for binding and imaging amyloid plaques and their use
  申请人：Röhn Ulrike

  公开号：US20120237446A1

  公开（公告）日：2012-09-20

  The present invention relates to novel compounds (3-aminopropen-1-ones) useful for binding and imaging beta amyloid deposits and their use in detecting or treating Alzheimer's disease and amyloidosis.

  本发明涉及新型化合物（3-氨基丙烯酮），用于结合和成像β淀粉样沉积物，以及它们在检测或治疗阿尔茨海默病和淀粉样病中的应用。