2-Chloro-6-(4-methylpiperidin-1-yl)pyrazine | 885704-66-5

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: 2-Chloro-6-(4-methylpiperidin-1-yl)pyrazine
• CAS: 885704-66-5
• 化学式: C₁₀H₁₄ClN₃
• mdl: MFCD10614662
• 分子量: 211.694
• InChiKey: VBKTYBAQFJUFJS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  14
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.6
• 拓扑面积：
  29
• 氢给体数：
  0
• 氢受体数：
  3

安全信息

• 危险等级：
  IRRITANT

反应信息

• 作为反应物：
  描述：

  2-Chloro-6-(4-methylpiperidin-1-yl)pyrazine 在 nitronium tetrafluoborate 作用下， 以 乙腈 为溶剂， 以8%的产率得到5-Chloro-3-(4-methyl-1-piperidinyl)-2-nitropyrazine
  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-甲基哌啶 、 2,6-二氯吡嗪 以 四氢呋喃 为溶剂， 生成 2-Chloro-6-(4-methylpiperidin-1-yl)pyrazine
  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

• Discovery of novel FMS kinase inhibitors as anti-inflammatory agents
  作者：Carl R. Illig、Jinsheng Chen、Mark J. Wall、Kenneth J. Wilson、Shelley K. Ballentine、M. Jonathan Rudolph、Renee L. DesJarlais、Yanmin Chen、Carsten Schubert、Ioanna Petrounia、Carl S. Crysler、Christopher J. Molloy、Margery A. Chaikin、Carl L. Manthey、Mark R. Player、Bruce E. Tomczuk、Sanath K. Meegalla

  DOI：10.1016/j.bmcl.2008.01.059

  日期：2008.3

  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.