N-(2-aminoimidazol-1-yl)acetamide | 1218792-60-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: N-(2-aminoimidazol-1-yl)acetamide
• CAS: 1218792-60-9
• 化学式: C₅H₈N₄O
• mdl: MFCD19215758
• 分子量: 140.145
• InChiKey: XUIWAXFQGDXSPJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.7
• 重原子数：
  10
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  72.9
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  N-(2-aminoimidazol-1-yl)acetamide 在 N-氯代丁二酰亚胺 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 生成 N-(2-amino-5-chloroimidazol-1-yl)acetamide
  参考文献：
  名称：

  Novel small molecule bradykinin B1 receptor antagonists. Part 2: 5-membered diaminoheterocycles

  摘要：

  Efforts to find new bradykinin B-1 receptor antagonists identified 2-aminobenzimidazole as a novel core. Subsequent transformation into five-membered diaminoheterocycle derivatives and their synthesis and SAR is described. This resulted in compounds with low nanomolar activity. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2009.11.120
• 作为产物：
  描述：

  氯乙醛 、 氰胺 、 乙酰肼 以 溶剂黄146 为溶剂， 生成 N-(2-aminoimidazol-1-yl)acetamide
  参考文献：
  名称：

  Novel small molecule bradykinin B1 receptor antagonists. Part 2: 5-membered diaminoheterocycles

  摘要：

  Efforts to find new bradykinin B-1 receptor antagonists identified 2-aminobenzimidazole as a novel core. Subsequent transformation into five-membered diaminoheterocycle derivatives and their synthesis and SAR is described. This resulted in compounds with low nanomolar activity. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2009.11.120

文献信息

• Novel small molecule bradykinin B1 receptor antagonists. Part 2: 5-membered diaminoheterocycles
  作者：Gunther Zischinsky、Roland Stragies、Marco Schaudt、Jochen R. Pfeifer、Christoph Gibson、Elsa Locardi、Dirk Scharn、Uwe Richter、Holger Kalkhof、Klaus Dinkel、Karsten Schnatbaum

  DOI：10.1016/j.bmcl.2009.11.120

  日期：2010.2

  Efforts to find new bradykinin B-1 receptor antagonists identified 2-aminobenzimidazole as a novel core. Subsequent transformation into five-membered diaminoheterocycle derivatives and their synthesis and SAR is described. This resulted in compounds with low nanomolar activity. (C) 2009 Elsevier Ltd. All rights reserved.