N-Methoxy-4-[(2-methoxyethoxy)methyl]-N-methylbenzamide | 500165-02-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: N-Methoxy-4-[(2-methoxyethoxy)methyl]-N-methylbenzamide
• 英文别名: N-methoxy-4-(2-methoxyethoxymethyl)-N-methylbenzamide
• CAS: 500165-02-6
• 化学式: C₁₃H₁₉NO₄
• 分子量: 253.298
• InChiKey: MFDUBANTKQQBFU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.9
• 重原子数：
  18
• 可旋转键数：
  7
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.46
• 拓扑面积：
  48
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  N-Methoxy-4-[(2-methoxyethoxy)methyl]-N-methylbenzamide 在 盐酸 、 正丁基锂 作用下， 以 四氢呋喃 、 正己烷 为溶剂， 反应 20.0h， 生成 6-[4-[(2-methoxyethoxy)methyl]phenyl]-5-methyl-3-phenyl-isoxazolo[4,5-c]pyridin-4(5H)-one
  参考文献：
  名称：

  Identification of a series of highly potent activators of the Nurr1 signaling pathway

  摘要：

  The nuclear receptor Nurr1 (NR4A2) is critically involved in the development and maintenance of midbrain dopaminergic neurons and is believed to function independently of endogenous activation. The hit identification and SAR studies leading to isoxazolo-pyridinone 7e, a highly potent, brain penetrable activator of the Nurr1 signaling pathway, are described. (c) 2006 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2006.09.062
• 作为产物：
  描述：

  4-((2-甲氧基乙氧基)甲基)苯甲酸 在 氯化亚砜 、 N,N-二异丙基乙胺 、 N,N-二甲基甲酰胺 作用下， 以 1,2-二氯乙烷 为溶剂， 反应 13.0h， 生成 N-Methoxy-4-[(2-methoxyethoxy)methyl]-N-methylbenzamide
  参考文献：
  名称：

  Identification of a series of highly potent activators of the Nurr1 signaling pathway

  摘要：

  The nuclear receptor Nurr1 (NR4A2) is critically involved in the development and maintenance of midbrain dopaminergic neurons and is believed to function independently of endogenous activation. The hit identification and SAR studies leading to isoxazolo-pyridinone 7e, a highly potent, brain penetrable activator of the Nurr1 signaling pathway, are described. (c) 2006 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2006.09.062

文献信息

• Isoxazolopyridinones
  申请人：——

  公开号：US20040248893A1

  公开（公告）日：2004-12-09

  The invention provides compounds of formula I, wherein X, Y, R 1 , R 2 , and R 3 are as defined in the description, and the preparation thereof. The compounds of formula I are useful as pharmaceuticals. 1

  本发明提供了I式化合物，其中X，Y，R1，R2和R3的定义如描述中所述，并提供了其制备方法。I式化合物可用作药物。
• ISOXAZOLOPYRIDINONES
  申请人：Novartis AG

  公开号：EP1418912B1

  公开（公告）日：2007-02-28
• US7087756B2
  申请人：——

  公开号：US7087756B2

  公开（公告）日：2006-08-08
• [EN] ISOXAZOLOPYRIDINONES<br/>[FR] ISOXAZOLOPYRIDINONES
  申请人：NOVARTIS AG

  公开号：WO2003015780A2

  公开（公告）日：2003-02-27

  The invention provides compounds of formula I , wherein X, Y, R1, R2, and R3 are as defined in the description, and the preparation thereof. The compounds of formula I are useful as pharmaceuticals for the treatment of perkinson's disease.
• Identification of a series of highly potent activators of the Nurr1 signaling pathway
  作者：Samuel Hintermann、Michele Chiesi、Ulrike von Krosigk、Danièle Mathé、Richard Felber、Bastian Hengerer

  DOI：10.1016/j.bmcl.2006.09.062

  日期：2007.1

  The nuclear receptor Nurr1 (NR4A2) is critically involved in the development and maintenance of midbrain dopaminergic neurons and is believed to function independently of endogenous activation. The hit identification and SAR studies leading to isoxazolo-pyridinone 7e, a highly potent, brain penetrable activator of the Nurr1 signaling pathway, are described. (c) 2006 Elsevier Ltd. All rights reserved.