(1S)-1-(4-Ethoxyphenyl)-2,2,2-trifluoroethanamine | 1213930-81-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: (1S)-1-(4-Ethoxyphenyl)-2,2,2-trifluoroethanamine
• CAS: 1213930-81-4
• 化学式: C₁₀H₁₂F₃NO
• 分子量: 219.207
• InChiKey: JYVFWICHKIJYQB-VIFPVBQESA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  15
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  35.2
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  2,4-二氯-6-异丙基-5,6-二氢吡咯并[3,4-d]嘧啶-7-酮 、 (1S)-1-(4-Ethoxyphenyl)-2,2,2-trifluoroethanamine 在 N,N-二异丙基乙胺 作用下， 以 二氯甲烷 为溶剂， 生成
  参考文献：
  名称：

  Discovery of P2X3 selective antagonists for the treatment of chronic pain

  摘要：

  Purinergic receptor P2X3 has been linked to analgesia in a number of pre-clinical models of pain, and is expressed in the human pain perception pathway. Only few P2X3-selective antagonists have been reported to date. This Letter describes the SAR and in vivo analgesic profile of a novel scaffold of selective P2X3 antagonists. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2012.01.124

文献信息

• Discovery of P2X3 selective antagonists for the treatment of chronic pain
  作者：Louis-David Cantin、Malken Bayrakdarian、Christophe Buon、Eric Grazzini、Yun-Jin Hu、Jean Labrecque、Carmen Leung、Xuehong Luo、Giovanni Martino、Michel Paré、Kemal Payza、Nirvana Popovic、Denis Projean、V. Santhakumar、Christopher Walpole、Xiao Hong Yu、Mirosław J. Tomaszewski

  DOI：10.1016/j.bmcl.2012.01.124

  日期：2012.4

  Purinergic receptor P2X3 has been linked to analgesia in a number of pre-clinical models of pain, and is expressed in the human pain perception pathway. Only few P2X3-selective antagonists have been reported to date. This Letter describes the SAR and in vivo analgesic profile of a novel scaffold of selective P2X3 antagonists. (C) 2012 Elsevier Ltd. All rights reserved.