4-[[5-(1-Methylindazol-3-yl)furan-2-yl]methyl]morpholine | 1345965-48-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并吡唑类
• 英文名称: 4-[[5-(1-Methylindazol-3-yl)furan-2-yl]methyl]morpholine
• CAS: 1345965-48-1
• 化学式: C₁₇H₁₉N₃O₂
• 分子量: 297.357
• InChiKey: SZKHXBCVBQIEEK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.8
• 重原子数：
  22
• 可旋转键数：
  3
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.35
• 拓扑面积：
  43.4
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  5-甲醛基呋喃-2-硼酸 在 四(三苯基膦)钯 、 palladium on activated charcoal 、 氢气 、 碳酸氢钠 作用下， 以 四氢呋喃 、 乙二醇二甲醚 、 水 为溶剂， 生成 4-[[5-(1-Methylindazol-3-yl)furan-2-yl]methyl]morpholine
  参考文献：
  名称：

  Design, synthesis and insight into the structure–activity relationship of 1,3-disubstituted indazoles as novel HIF-1 inhibitors

  摘要：

  Design, synthesis and insight into the structure-activity relationship (SAR) of 1,3-disubstituted indazoles as novel HIF-1 inhibitors are described. In particular, the substituted furan moiety on indazole skeleton as well as its substitution pattern turns out crucial for the high HIF-1 inhibition. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2011.08.120

文献信息

• Design, synthesis and insight into the structure–activity relationship of 1,3-disubstituted indazoles as novel HIF-1 inhibitors
  作者：Hongchan An、Nam-Jung Kim、Jong-Wha Jung、Hannah Jang、Jong-Wan Park、Young-Ger Suh

  DOI：10.1016/j.bmcl.2011.08.120

  日期：2011.11

  Design, synthesis and insight into the structure-activity relationship (SAR) of 1,3-disubstituted indazoles as novel HIF-1 inhibitors are described. In particular, the substituted furan moiety on indazole skeleton as well as its substitution pattern turns out crucial for the high HIF-1 inhibition. (C) 2011 Elsevier Ltd. All rights reserved.