1-(3,4-dihydronaphthalen-1-yl)-1H-imidazole | 1282035-45-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 1-(3,4-dihydronaphthalen-1-yl)-1H-imidazole
• CAS: 1282035-45-3
• 化学式: C₁₃H₁₂N₂
• 分子量: 196.252
• InChiKey: RPVRGIKCTZOXBA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.72
• 重原子数：
  15.0
• 可旋转键数：
  1.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.15
• 拓扑面积：
  17.82
• 氢给体数：
  0.0
• 氢受体数：
  2.0

反应信息

• 作为产物：
  描述：

  (+/-)-cis-1-amino-2-hydroxy-1,2,3,4-tetrahydronaphthalene 在 ammonium acetate 、 sodium hydride 作用下， 以 水 、 N,N-二甲基甲酰胺 、 mineral oil 为溶剂， 反应 8.0h， 生成 1-(3,4-dihydronaphthalen-1-yl)-1H-imidazole
  参考文献：
  名称：

  Design and synthesis of novel tetrahydronaphthyl azoles and related cyclohexyl azoles as antileishmanial agents

  摘要：

  A novel series of trans-2-aryloxy-1,2,3,4,-tetrahydronaphthyl azoles and related cyclohexyl azoles were synthesized and evaluated in vitro against Leishmania donovani. Compound 9 identified as most active analog with IC50 value of 0.64 mu g/mL and SI value of 34.78 against amastigotes, and is several folds more potent than the reference drugs sodium stilbogluconate and paromomycin. It also exhibited significant in vivo inhibition of 83.33%, and provided a new structural scaffold for antileishmanials. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2011.01.026