N-[(Z/E)-1-((morpholin-4-yl)carbonyl)-2-phenylvinyl]benzamide | 75667-46-8

• 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-[(Z/E)-1-((morpholin-4-yl)carbonyl)-2-phenylvinyl]benzamide
• 英文别名: 4-(2-benzoylamino-3-phenyl-acryloyl)-morpholine；4-(α-benzoylamino-trans-cinnamoyl)-morpholine；4-(α-Benzoylamino-trans-cinnamoyl)-morpholin；N-(3-morpholin-4-yl-3-oxo-1-phenylprop-1-en-2-yl)benzamide
• CAS: 75667-46-8
• 化学式: C₂₀H₂₀N₂O₃
• 分子量: 336.39
• InChiKey: YGMCKSSZFBMEPR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  25
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  58.6
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  N-[(Z/E)-1-((morpholin-4-yl)carbonyl)-2-phenylvinyl]benzamide 在 copper(l) iodide 、 溴 、 N,N-二甲基甘氨酸盐酸盐 、 caesium carbonate 、 calcium carbonate 作用下， 以 1,4-二氧六环 、 氯仿 为溶剂， 生成 (2,5-diphenyloxazol-4-yl)(morpholino)methanone
  参考文献：
  名称：

  简明的方法来从多取代恶唑Ñ酰基-2-溴烯酰胺经由铜（我）/氨基酸催化的分子内C-O键形成†

  摘要：

  已经开发出一种简单有效的铜（I）/氨基酸催化的分子内乌尔曼型C–O偶联反应。该方案提供了在温和的条件下从容易获得的N-酰基2-溴代酰胺类化合物合成一系列新颖的2,4,5-取代的恶唑的简便方法。

  DOI：

  10.1039/c4ob00309h
• 作为产物：
  描述：

  苯甲醛 在 乙酸酐 、 三乙胺 作用下， 以 氯仿 为溶剂， 生成 N-[(Z/E)-1-((morpholin-4-yl)carbonyl)-2-phenylvinyl]benzamide
  参考文献：
  名称：

  简明的方法来从多取代恶唑Ñ酰基-2-溴烯酰胺经由铜（我）/氨基酸催化的分子内C-O键形成†

  摘要：

  已经开发出一种简单有效的铜（I）/氨基酸催化的分子内乌尔曼型C–O偶联反应。该方案提供了在温和的条件下从容易获得的N-酰基2-溴代酰胺类化合物合成一系列新颖的2,4,5-取代的恶唑的简便方法。

  DOI：

  10.1039/c4ob00309h

文献信息

• Aminocarbonyl Arylvinylbenzamides as Gastric Sparing Anti-inflammatory Agents
  作者：Saurabh C. Khadse、Gokul S. Talele、Surendra S. Agrawal

  DOI：10.1002/ardp.201000096

  日期：2011.5

  Some (E/Z)‐aminocarbonyl arylvinylbenzamides (B1–B15) were synthesized, evaluated for anti‐inflammatory activity and ulcerogenic tendency, and their effect on gastro‐intestinal motility in the rats was studied. These benzamides comprising of aliphatic unsaturated region situated between two amide linkages were synthesized by nucleophilic ring opening of appropriate azlactones (AZ1–AZ4) by suitable

  合成了一些（E / Z）-氨基羰基芳基乙烯基苯甲酰胺（B1-B15），评估了抗炎活性和溃疡形成趋势，并研究了它们对大鼠胃肠动力的影响。这些包含位于两个酰胺键之间的脂肪族不饱和区域的苯甲酰胺是通过合适的胺使合适的吖内酯 (AZ1-AZ4) 亲核开环合成的。新合成的苯甲酰胺的表征是通过 IR、1H-和 13C-NMR、质量和元素分析进行​​的。在测试的化合物中，苯甲酰胺 B1、B2、B4、B5 和 B13 在 10 和 20 mg/kg po 下能够产生相当或更好的抗炎活性
• α-amino acrylate microbicide, and preparation method therefor and uses thereof
  申请人：NANKAI UNIVERSITY

  公开号：US11166460B2

  公开（公告）日：2021-11-09

  The present invention relates to a microbicidal α-amino acrylic derivative and its preparation method and applications. Based on the principle of pesticide molecular design, the structural reform of the agricultural anti-plant virus activity is carried on lead compounds having the medical anti-coronavirus activity, and a series of α-amino acrylic derivatives are designed and synthesized, and in particular, α-amino acrylic derivatives containing piperidine rings are synthesized, and the systematic biological activity screening is carried by using known compounds as positive control compounds, which provide many effective anti-virus leading molecules for the preparation of pesticides, and has positive significance to reduce the pesticide application dosage and protect the environment and ecology.

  本发明涉及一种杀微生物的α-氨基丙烯酸衍生物及其制备方法和应用。根据农药分子设计原理，对具有医用抗柯洛病毒活性的先导化合物进行农业抗植物病毒活性的结构改造，设计合成了一系列α-氨基丙烯酸衍生物，特别是合成了含有哌啶环的α-氨基丙烯酸衍生物、并以已知化合物为阳性对照化合物进行了系统的生物活性筛选，为农药制备提供了多种有效的抗病毒先导分子，对减少农药用量、保护环境和生态具有积极意义。
• Khadse; Talele; Agarwal, Indian Journal of Heterocyclic Chemistry, 2010, vol. 19, # 3, p. 277 - 280
  作者：Khadse、Talele、Agarwal

  DOI：——

  日期：——
• The Reaction of Azlactones with Secondary Amines
  作者：David K. Barnes、E. Campaigne、R. L. Shriner

  DOI：10.1021/ja01185a030

  日期：1948.5
• a-Amino Acrylate microbicide, and preparation method therefor and uses thereof
  申请人：NANKAI UNIVERSITY

  公开号：US20200236935A1

  公开（公告）日：2020-07-30

  The present invention relates to a microbicidal α-amino acrylic derivative and its preparation method and applications. Based on the principle of pesticide molecular design, the structural reform of the agricultural anti-plant virus activity is carried on lead compounds having the medical anti-coronavirus activity, and a series of α-amino acrylic derivatives are designed and synthesized, and in particular, α-amino acrylic derivatives containing piperidine rings are synthesized, and the systematic biological activity screening is carried by using known compounds as positive control compounds, which provide many effective anti-virus leading molecules for the preparation of pesticides, and has positive significance to reduce the pesticide application dosage and protect the environment and ecology.