N-[3-chloro-4-(4-ethylpiperazin-1-yl)phenyl]-2-phenylmethoxyacetamide | 1012788-59-8

• 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: N-[3-chloro-4-(4-ethylpiperazin-1-yl)phenyl]-2-phenylmethoxyacetamide
• CAS: 1012788-59-8
• 化学式: C₂₁H₂₆ClN₃O₂
• 分子量: 387.909
• InChiKey: SOYBOJZGAPAEEA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.4
• 重原子数：
  27
• 可旋转键数：
  7
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  44.8
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  3-chloro-4-(4-ethylpiperazin-1-yl)aniline 、 苄氧基乙酰氯 在 PS-DIEA 作用下， 生成 N-[3-chloro-4-(4-ethylpiperazin-1-yl)phenyl]-2-phenylmethoxyacetamide
  参考文献：
  名称：

  Synthesis and SAR of selective muscarinic acetylcholine receptor subtype 1 (M1 mAChR) antagonists

  摘要：

  This Letter describes the synthesis and SAR, developed through an iterative analogue library approach, of a novel series of selective M1 mAChR antagonists for the potential treatment of Parkinson's disease, dystonia, and other movement disorders. Compounds in this series possess M1 antagonist IC50S in the 441 nM-19 mu M range with 8- to >340-fold functional selectivity versus rM2-rM5. (C) 2007 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2007.12.051

文献信息

• Synthesis and SAR of selective muscarinic acetylcholine receptor subtype 1 (M1 mAChR) antagonists
  作者：L. Michelle Lewis、Douglas Sheffler、Richard Williams、Thomas M. Bridges、J. Phillip Kennedy、J.T. Brogan、Matthew J. Mulder、Lyndsey Williams、Natalia T. Nalywajko、Colleen M. Niswender、Charles D. Weaver、P. Jeffrey Conn、Craig W. Lindsley

  DOI：10.1016/j.bmcl.2007.12.051

  日期：2008.2

  This Letter describes the synthesis and SAR, developed through an iterative analogue library approach, of a novel series of selective M1 mAChR antagonists for the potential treatment of Parkinson's disease, dystonia, and other movement disorders. Compounds in this series possess M1 antagonist IC50S in the 441 nM-19 mu M range with 8- to >340-fold functional selectivity versus rM2-rM5. (C) 2007 Elsevier Ltd. All rights reserved.