allyl (S)-<<3-<(tert-butoxycarbonyl)amino>-2-oxo-1-azetidinyl>imino>acetate | 121142-83-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 内酰胺类
• 英文名称: allyl (S)-<<3-<(tert-butoxycarbonyl)amino>-2-oxo-1-azetidinyl>imino>acetate
• 英文别名: prop-2-enyl 2-[(3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxoazetidin-1-yl]iminoacetate
• CAS: 121142-83-4
• 化学式: C₁₃H₁₉N₃O₅
• 分子量: 297.311
• InChiKey: JDKUPGXUAOWXRX-VIFPVBQESA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.2
• 重原子数：
  21
• 可旋转键数：
  8
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  97.3
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  allyl (S)-<<3-<(tert-butoxycarbonyl)amino>-2-oxo-1-azetidinyl>imino>acetate 、 三氟乙酸 反应 1.0h， 以67%的产率得到allyl (S)-<(3-amino-2-oxo-1-azetidinyl)imino>acetate trifluoroacetate
  参考文献：
  名称：

  N-Azamonobactams. 2. Synthesis of some N-iminoacetic acid and N-glycyl analogs

  摘要：

  The synthesis of the title compounds has been accomplished. The N-iminoacetic acid analogues (12a and 12b) containing the aminothiazole type side chain exhibited good in vitro antibacterial activity against Gram-negative organisms. The corresponding N-glycyl derivative (17) was not active.

  DOI：

  10.1021/jm00128a014
• 作为产物：
  描述：

  allyl 2-oxoacetate 、 3-<(tert-butoxycarbonyl)amino>-2-oxo-1-aminoazetidine 以 甲苯 为溶剂， 反应 1.0h， 以60%的产率得到allyl (S)-<<3-<(tert-butoxycarbonyl)amino>-2-oxo-1-azetidinyl>imino>acetate
  参考文献：
  名称：

  N-Azamonobactams. 2. Synthesis of some N-iminoacetic acid and N-glycyl analogs

  摘要：

  The synthesis of the title compounds has been accomplished. The N-iminoacetic acid analogues (12a and 12b) containing the aminothiazole type side chain exhibited good in vitro antibacterial activity against Gram-negative organisms. The corresponding N-glycyl derivative (17) was not active.

  DOI：

  10.1021/jm00128a014

文献信息

• N-Azamonobactams. 2. Synthesis of some N-iminoacetic acid and N-glycyl analogs
  作者：William V. Curran、Robert H. Lenhard

  DOI：10.1021/jm00128a014

  日期：1989.8

  The synthesis of the title compounds has been accomplished. The N-iminoacetic acid analogues (12a and 12b) containing the aminothiazole type side chain exhibited good in vitro antibacterial activity against Gram-negative organisms. The corresponding N-glycyl derivative (17) was not active.