(E)-4-(2-methoxybenzylidene)-2-methyloxazol-5(4H)-one | 1019201-46-7

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: (E)-4-(2-methoxybenzylidene)-2-methyloxazol-5(4H)-one
• 英文别名: 4-(2-Methoxybenzylidene)-2-methyloxazol-5(4H)-one；(4E)-4-[(2-methoxyphenyl)methylidene]-2-methyl-1,3-oxazol-5-one
• CAS: 1019201-46-7
• 化学式: C₁₂H₁₁NO₃
• 分子量: 217.224
• InChiKey: HSKVPAFMAZDKCS-JXMROGBWSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.9
• 重原子数：
  16
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  47.9
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  (3-甲氧基苯甲酰基氨基)-乙酸 在 sodium acetate 、 乙酸酐 作用下， 以 乙腈 为溶剂， 反应 4.0h， 生成 (E)-4-(2-methoxybenzylidene)-2-methyloxazol-5(4H)-one
  参考文献：
  名称：

  Benzylidene-Oxazolones as Molecular Photoswitches

  摘要：

  The synthesis and photochemical study of a family of molecular switches inspired by the green fluorescent protein (UP) chromophore is presented. These compounds can be easily synthesized, and their photophysical properties may be tuned. Due to their efficient photoisomerization and high stability, these compounds can be switched on/off by using light and heat or light with different wavelengths.

  DOI：

  10.1021/ol301741g

文献信息

• Phenoxypropylamine compounds
  申请人：——

  公开号：US20020111358A1

  公开（公告）日：2002-08-15

  The present invention relates to a phenoxypropylamine compound of the formula (I) 1 wherein each symbol is as defined in the specification, an optically active compound thereof or a pharmaceutically acceptable salt thereof and hydrates thereof, which simultaneously show selective affinity for and antagonistic activity against 5-HT 1A receptor, as well as 5-HT reuptake inhibitory activity, and can be used as antidepressants quick in expressing an anti-depressive effect.

  本发明涉及一种公式（I）中的苯氧丙胺化合物： 1 其中每个符号如说明书中所定义，其光学活性化合物或其药物可接受的盐及水合物，同时显示出对5-HT 1A 受体的选择性亲和力和拮抗活性，以及5-HT再摄取抑制活性，并且可以用作快速表达抗抑郁效果的抗抑郁药。
• Oxazolone-Based Photoswitches: Synthesis and Properties
  作者：Marina Blanco-Lomas、Ignacio Funes-Ardoiz、Pedro J. Campos、Diego Sampedro

  DOI：10.1002/ejoc.201300641

  日期：2013.10

  synthesis, photophysics and photochemistry of a family of molecular switches inspired by the green fluorescent protein (GFP) chromophore is presented. These compounds can be synthesized in one step and good yields, their photophysical properties may be tuned by the substituents, solvent and wavelength of irradiation, and they show very efficient and fast photoisomerization. Furthermore, their high thermal

  介绍了受绿色荧光蛋白 (GFP) 生色团启发的一系列分子开关的合成、光物理学和光化学。这些化合物可以一步合成，产率高，它们的光物理性质可以通过取代基、溶剂和照射波长进行调节，并且它们表现出非常有效和快速的光异构化。此外，它们的高热稳定性和有限的光分解可以使这些开关用于一系列应用。最后，恶唑酮光开关可以通过使用光激活，并通过热或不同波长的光停用。
• PHENOXYPROPYLAMINE COMPOUNDS
  申请人：Mitsubishi Pharma Corporation

  公开号：EP1188747B1

  公开（公告）日：2005-09-07
• Benzylidene–oxazolones as photoswitches: photochemistry and theoretical calculations
  作者：Ignacio Funes-Ardoiz、Marina Blanco-Lomas、Pedro J. Campos、Diego Sampedro

  DOI：10.1016/j.tet.2013.09.009

  日期：2013.11

  The photophysics and photochemistry of a family of compounds proposed as efficient molecular photoswitches is presented. The effect of different light sources, substituents and solvents in the photostationary state has been explored. A detailed mechanistic description is also discussed. (C) 2013 Elsevier Ltd. All rights reserved.
• US6720320B2
  申请人：——

  公开号：US6720320B2

  公开（公告）日：2004-04-13