(E)-2-(3-chlorophenyl)-1-(2-(7-chloroquinolin-4-ylamino)ethyl)-3-(4-(4-methoxyphenoxy)phenyl)guanidine | 1596272-01-3

• 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: (E)-2-(3-chlorophenyl)-1-(2-(7-chloroquinolin-4-ylamino)ethyl)-3-(4-(4-methoxyphenoxy)phenyl)guanidine
• 英文别名: 2-(3-Chlorophenyl)-1-[2-[(7-chloro-4-quinolyl)amino]ethyl]-3-[4-(4-methoxyphenoxy)phenyl]guanidine；1-(3-chlorophenyl)-2-[2-[(7-chloroquinolin-4-yl)amino]ethyl]-3-[4-(4-methoxyphenoxy)phenyl]guanidine
• CAS: 1596272-01-3
• 化学式: C₃₁H₂₇Cl₂N₅O₂
• 分子量: 572.494
• InChiKey: TYGNXIWCZWCLDS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.3
• 重原子数：
  40
• 可旋转键数：
  11
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.1
• 拓扑面积：
  79.8
• 氢给体数：
  3
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  [4-(4-甲氧基苯氧基)苯基]胺 在 三乙胺 、 mercury dichloride 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 生成 (E)-2-(3-chlorophenyl)-1-(2-(7-chloroquinolin-4-ylamino)ethyl)-3-(4-(4-methoxyphenoxy)phenyl)guanidine
  参考文献：
  名称：

  Synthesis and evaluation of new diaryl ether and quinoline hybrids as potential antiplasmodial and antimicrobial agents

  摘要：

  Synthesis and bioevaluation of new diaryl ether hybridized quinoline derivatives as antiplasmodial, antibacterial and antifungal agents is reported. It was encouraging to discover that several compounds displayed 2-3 folds better efficacy than chloroquine in chloroquine-resistant K1 strain of Plasmodium falciparum. Further, a few members of the library displayed good antibacterial efficacy against gram positive strains of bacteria but none of the compounds displayed any significant antifungal activity. (c) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2014.02.044

文献信息

• Synthesis and evaluation of new diaryl ether and quinoline hybrids as potential antiplasmodial and antimicrobial agents
  作者：Amita Mishra、Harikrishna Batchu、Kumkum Srivastava、Pratiksha Singh、Pravin K. Shukla、Sanjay Batra

  DOI：10.1016/j.bmcl.2014.02.044

  日期：2014.4

  Synthesis and bioevaluation of new diaryl ether hybridized quinoline derivatives as antiplasmodial, antibacterial and antifungal agents is reported. It was encouraging to discover that several compounds displayed 2-3 folds better efficacy than chloroquine in chloroquine-resistant K1 strain of Plasmodium falciparum. Further, a few members of the library displayed good antibacterial efficacy against gram positive strains of bacteria but none of the compounds displayed any significant antifungal activity. (c) 2014 Elsevier Ltd. All rights reserved.