N-[4-(4-bromophenyl)-1-cyclopentylpiperidin-4-yl]acetamide | 538324-19-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 哌啶类
• 英文名称: N-[4-(4-bromophenyl)-1-cyclopentylpiperidin-4-yl]acetamide
• CAS: 538324-19-5
• 化学式: C₁₈H₂₅BrN₂O
• 分子量: 365.313
• InChiKey: AFTBPBCIHFBZEN-UHFFFAOYSA-N

物化性质

• 沸点：
  499.9±45.0 °C(Predicted)
• 密度：
  1.33±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.4
• 重原子数：
  22
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.61
• 拓扑面积：
  32.3
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  N-[4-(4-bromophenyl)-1-cyclopentylpiperidin-4-yl]acetamide 在 盐酸 、 potassium carbonate 作用下， 生成
  参考文献：
  名称：

  Synthesis and structure–activity relationships of piperidine-based melanin-concentrating hormone receptor 1 antagonists

  摘要：

  Isosteric replacement of the urea group of lead compound 1 led to novel substituted piperidine phenylamide analogues. SAR on the electron-induced effects of various linkers as well as substituents on the phenyl rings and the piperidine nitrogen has been investigated. Many single-digit nanomolar MCH R1 antagonists have been identified from this series. (c) 2006 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2006.04.061
• 作为产物：
  描述：

  环戊酮 在 硫酸 、 三乙酰氧基硼氢化钠 作用下， 以 二氯甲烷 为溶剂， 生成 N-[4-(4-bromophenyl)-1-cyclopentylpiperidin-4-yl]acetamide
  参考文献：
  名称：

  Synthesis and structure–activity relationships of piperidine-based melanin-concentrating hormone receptor 1 antagonists

  摘要：

  Isosteric replacement of the urea group of lead compound 1 led to novel substituted piperidine phenylamide analogues. SAR on the electron-induced effects of various linkers as well as substituents on the phenyl rings and the piperidine nitrogen has been investigated. Many single-digit nanomolar MCH R1 antagonists have been identified from this series. (c) 2006 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2006.04.061

文献信息

• PIPERIDINE-BASED MCH ANTAGONISTS FOR TREATMENT OF OBESITY AND CNS DISORDERS
  申请人：Schering Corporation

  公开号：EP1448526B1

  公开（公告）日：2009-10-21