N-[3'-(1H-imidazol-1''-yl)propyl]phenazine-1-carboxamide | 1261237-13-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二氮杂萘
• 英文名称: N-[3'-(1H-imidazol-1''-yl)propyl]phenazine-1-carboxamide
• 英文别名: N-[3'-(1H-imidazol-1"-yl)propyl]phenazine-1-carboxamide
• CAS: 1261237-13-1
• 化学式: C₁₉H₁₇N₅O
• 分子量: 331.377
• InChiKey: RPNLQUIJFSHUBJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  25.0
• 可旋转键数：
  5.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.16
• 拓扑面积：
  72.7
• 氢给体数：
  1.0
• 氢受体数：
  5.0

反应信息

• 作为产物：
  描述：

  1-(3-氨基丙基)咪唑 、 phenazine-1-carbonyl chloride 在 三乙胺 作用下， 以 二氯甲烷 为溶剂， 生成 N-[3'-(1H-imidazol-1''-yl)propyl]phenazine-1-carboxamide
  参考文献：
  名称：

  Phenazine-1-carboxylic acid derivatives: Design, synthesis and biological evaluation against Rhizoctonia solani Kuhn

  摘要：

  Rhizoctonia solani Kuhn is the pathogen that causes sheath blight and results in significant yield reduction in rice and in nearly 50 other crops. In order to develop a new fungicide effective against this pathogen, a series of structurally diverse phenazine-1-carboxylic acid derivatives, 2a, 2b, 2c, 2d, 2e, 2f, 2g, 2h, 2i, 2j, and 2k, were designed, synthesized and evaluated for their antifungal activity. The two most active compounds 2i and 2j were selected as lead compounds for further antifungal research. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2010.10.050