(Z)-N-(1-((methylamino)carbonyl)-2-phenylethenyl)benzamide | 110465-31-1

• 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: (Z)-N-(1-((methylamino)carbonyl)-2-phenylethenyl)benzamide
• 英文别名: N-Methyl 2-benzoylaminocinnamide；α-benzoylamino-trans-cinnamic acid methylamide；α-Benzoylamino-trans-zimtsaeure-methylamid；N-(1-Methylcarbamoyl-2-phenyl-vinyl)-benzamide；N-[(Z)-3-(methylamino)-3-oxo-1-phenylprop-1-en-2-yl]benzamide
• CAS: 110465-31-1
• 化学式: C₁₇H₁₆N₂O₂
• 分子量: 280.326
• InChiKey: AXVSZITUXIBVLQ-QINSGFPZSA-N

物化性质

• 熔点：
  188-189 °C(Solvent: Ethanol)
• 沸点：
  579.5±50.0 °C(Predicted)
• 密度：
  1.180±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.1
• 重原子数：
  21
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.06
• 拓扑面积：
  58.2
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  甲胺 、 (4Z)-4-benzylidene-2-phenyl-1,3-oxazol-5(4H)-one 生成 (Z)-N-(1-((methylamino)carbonyl)-2-phenylethenyl)benzamide
  参考文献：
  名称：

  Kjaer, Acta Chemica Scandinavica (1947), 1953, vol. 7, p. 889,896

  摘要：

  DOI：

文献信息

• 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。
• Ashare, Ram; Mukerjee, Arya K., Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1986, vol. 25, p. 762 - 764
  作者：Ashare, Ram、Mukerjee, Arya K.

  DOI：——

  日期：——
• ASHARE RAM; MUKERJEE ARYA K., INDIAN J. CHEM., 25,(1986) N 7, 762-764
  作者：ASHARE RAM、 MUKERJEE ARYA K.

  DOI：——

  日期：——
• 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.
• Kjaer, Acta Chemica Scandinavica (1947), 1953, vol. 7, p. 889,896
  作者：Kjaer

  DOI：——

  日期：——