N-benzoyl-N'-carboxy-2-hydroxypropylidenethiourea

• 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: N-benzoyl-N'-carboxy-2-hydroxypropylidenethiourea
• 英文别名: 2-(Benzoylcarbamothioylamino)-3-hydroxybutanoic acid
• 化学式: C₁₂H₁₄N₂O₄S
• 分子量: 282.32
• InChiKey: HZBRFUQMRBUQTD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  19
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  131
• 氢给体数：
  4
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  DL-Threonine 、 苯甲酰基异硫氰酸酯 在 吡啶 作用下， 以 丙酮 为溶剂， 反应 6.0h， 生成 N-benzoyl-N'-carboxy-2-hydroxypropylidenethiourea
  参考文献：
  名称：

  Synthesis and Characterization of N-benzoyl-N′-carboxyalkyl Substituted Thiourea Derivatives

  摘要：

  N-Benzoyl-N'-carboxyl substituted thiourea derivatives (I-X) have been synthesized by the reaction of benzoyl isothiocyanate with amino acids. Their structures are confirmed by IR, (HNMR)-H-1, and elemental analysis. The reaction conditions are experimentally investigated, and the preliminary biological tests show that some of the compounds have excellent plant growth promotion activities.

  DOI：

  10.1080/10426500307952

文献信息

• Synthesis and Characterization of N-benzoyl-N′-carboxyalkyl Substituted Thiourea Derivatives
  作者：Zhonghua Li、Yan Zhang、Yangang Wang

  DOI：10.1080/10426500307952

  日期：2003.2.1

  N-Benzoyl-N'-carboxyl substituted thiourea derivatives (I-X) have been synthesized by the reaction of benzoyl isothiocyanate with amino acids. Their structures are confirmed by IR, (HNMR)-H-1, and elemental analysis. The reaction conditions are experimentally investigated, and the preliminary biological tests show that some of the compounds have excellent plant growth promotion activities.