5-(4-Methylpiperazin-1-yl)-3-(4-methylpiperidin-1-yl)pyridin-2-amine | 1022921-63-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪烷类
• 英文名称: 5-(4-Methylpiperazin-1-yl)-3-(4-methylpiperidin-1-yl)pyridin-2-amine
• CAS: 1022921-63-6
• 化学式: C₁₆H₂₇N₅
• 分子量: 289.424
• InChiKey: RYOCYSOGFNTNKS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.8
• 重原子数：
  21
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.69
• 拓扑面积：
  48.6
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  5-cyanofuran-2-carbonyl chloride 、 5-(4-Methylpiperazin-1-yl)-3-(4-methylpiperidin-1-yl)pyridin-2-amine 在 三乙胺 作用下， 以 二氯甲烷 为溶剂， 生成 5-cyano-furan-2-carboxylic acid [4-methyl-5'-(4-methyl-piperazin-1-yl)-3,4,5,6-tetrahydro-2H-[1,3']bipyridinyl-2'-yl]-amide
  参考文献：
  名称：

  Discovery of novel FMS kinase inhibitors as anti-inflammatory agents

  摘要：

  The optimization of the arylamide lead 2 resulted in identification of a highly potent series of 2,4-disubstituted arylamides. Compound 8 (FMS kinase IC50 = 0.0008 mu M) served as a proof-of-concept candidate in a collagen-induced model of arthritis in mice. (c) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2008.01.059
• 作为产物：
  描述：

  4-methyl-5'-(4-methyl-piperazin-1-yl)-2'-nitro-3,4,5,6-tetrahydro-2H-[1,3']bipyridinyl 在 palladium on activated charcoal 氢气 作用下， 以 乙醇 为溶剂， 生成 5-(4-Methylpiperazin-1-yl)-3-(4-methylpiperidin-1-yl)pyridin-2-amine
  参考文献：
  名称：

  Discovery of novel FMS kinase inhibitors as anti-inflammatory agents

  摘要：

  The optimization of the arylamide lead 2 resulted in identification of a highly potent series of 2,4-disubstituted arylamides. Compound 8 (FMS kinase IC50 = 0.0008 mu M) served as a proof-of-concept candidate in a collagen-induced model of arthritis in mice. (c) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2008.01.059

文献信息

• AROMATIC AMIDES AS INHIBITORS OF C-FMS KINASE
  申请人：Janssen Pharmaceutica NV

  公开号：EP1807407B1

  公开（公告）日：2009-07-29