1-Methylimidazo[4,5-c]pyridine-4-carbonitrile | 1078168-20-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 咪唑并吡啶类
• 英文名称: 1-Methylimidazo[4,5-c]pyridine-4-carbonitrile
• 英文别名: 1-methylimidazo[4,5-c]pyridine-4-carbonitrile
• CAS: 1078168-20-3
• 化学式: C₈H₆N₄
• 分子量: 158.162
• InChiKey: AJJKTLNLXZJWJS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.4
• 重原子数：
  12
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  54.5
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  1-Methylimidazo[4,5-c]pyridine-4-carbonitrile 在 水 作用下， 以 1,4-二氧六环 为溶剂， 生成 1-Methyl-1H-imidazo[4,5-c]pyridine-4-carboxylic acid
  参考文献：
  名称：

  Structure-guided design of substituted aza-benzimidazoles as potent hypoxia inducible factor-1α prolyl hydroxylase-2 inhibitors

  摘要：

  We report the structure-based design and synthesis of a novel series of aza-benzimidazoles as PHD2 inhibitors. These efforts resulted in compound 22, which displayed highly potent inhibition of PHD2 function in vitro. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2008.08.012
• 作为产物：
  描述：

  三甲基氰硅烷 、 1-methyl-1H-imidazo[4,5-c]pyridine 5-oxide 在 二甲氨基甲酰氯 作用下， 以 二氯甲烷 为溶剂， 生成 1-Methylimidazo[4,5-c]pyridine-4-carbonitrile
  参考文献：
  名称：

  Structure-guided design of substituted aza-benzimidazoles as potent hypoxia inducible factor-1α prolyl hydroxylase-2 inhibitors

  摘要：

  We report the structure-based design and synthesis of a novel series of aza-benzimidazoles as PHD2 inhibitors. These efforts resulted in compound 22, which displayed highly potent inhibition of PHD2 function in vitro. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2008.08.012

文献信息

• 6-PHENYL-1H-IMIDAZO[4,5-C]PYRIDINE-4-CARBONITRILE DERIVATIVES AS CATHEPSIN S AND/OR CATHEPSIN K INHIBITORS
  申请人：Organon BioSciences Nederland B.V.

  公开号：EP2387573B1

  公开（公告）日：2013-07-31
• Structure-guided design of substituted aza-benzimidazoles as potent hypoxia inducible factor-1α prolyl hydroxylase-2 inhibitors
  作者：Mike Frohn、Vellarkad Viswanadhan、Alexander J. Pickrell、Jennifer E. Golden、Kristine M. Muller、Roland W. Bürli、Gloria Biddlecome、Sean C. Yoder、Norma Rogers、Jennifer H. Dao、Randall Hungate、Jennifer R. Allen

  DOI：10.1016/j.bmcl.2008.08.012

  日期：2008.9

  We report the structure-based design and synthesis of a novel series of aza-benzimidazoles as PHD2 inhibitors. These efforts resulted in compound 22, which displayed highly potent inhibition of PHD2 function in vitro. (C) 2008 Elsevier Ltd. All rights reserved.