1-(4-Benzenesulfonyl-4-methyl-pentyl)-piperidine-3-carboxylic acid methoxy-methyl-amide | 794532-29-9

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 1-(4-Benzenesulfonyl-4-methyl-pentyl)-piperidine-3-carboxylic acid methoxy-methyl-amide
• 英文别名: 1-[4-(benzenesulfonyl)-4-methylpentyl]-N-methoxy-N-methylpiperidine-3-carboxamide
• CAS: 794532-29-9
• 化学式: C₂₀H₃₂N₂O₄S
• 分子量: 396.551
• InChiKey: ZAZIRGQMZHJLDP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  27
• 可旋转键数：
  8
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.65
• 拓扑面积：
  75.3
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  1-(4-Benzenesulfonyl-4-methyl-pentyl)-piperidine-3-carboxylic acid methoxy-methyl-amide 在 二异丁基氢化铝 、 potassium carbonate 作用下， 以 甲醇 、 二氯甲烷 为溶剂， 生成 1-(4-Benzenesulfonyl-4-methyl-pentyl)-3-oxazol-5-yl-piperidine
  参考文献：
  名称：

  Aminoalkyl phenyl sulfones—a novel series of 5-HT7 receptor ligands

  摘要：

  A novel series of 5-HT7 receptor ligands has been identified and evaluated, providing compounds showing a broad spectrum of functional activities and good selectivity over selected receptors and ion channels. (C) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2005.11.067
• 作为产物：
  描述：

  3-哌啶甲酸乙酯 在 异丙基氯化镁 、 potassium carbonate 作用下， 以 四氢呋喃 、 乙腈 为溶剂， 生成 1-(4-Benzenesulfonyl-4-methyl-pentyl)-piperidine-3-carboxylic acid methoxy-methyl-amide
  参考文献：
  名称：

  Aminoalkyl phenyl sulfones—a novel series of 5-HT7 receptor ligands

  摘要：

  A novel series of 5-HT7 receptor ligands has been identified and evaluated, providing compounds showing a broad spectrum of functional activities and good selectivity over selected receptors and ion channels. (C) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2005.11.067

文献信息

• Sulfone derivatives as 5-HT7 receptor ligands
  申请人：——

  公开号：US20040229864A1

  公开（公告）日：2004-11-18

  The present invention relates to sulfone derivatives of formula (I): Ar—SO 2 —CR 2 R 3 -L-N(R 1 ) 2 I wherein Ar, L, R 1 , R 2 and R 3 are as defined herein, and pharmaceutically acceptable salts and N-oxides thereof, useful in the treatment of a condition which is susceptible to treatment by modulation of 5-HT 7 receptor activity, such as depression or a sleep disorder.

  本发明涉及式（I）的砜衍生物：Ar—SO2—CR2R3-L-N(R1)2I，其中Ar，L，R1，R2和R3如本文所定义，并且其药用盐和N-氧化物，用于治疗通过调节5-HT7受体活性可治疗的疾病，如抑郁症或睡眠障碍。
• Aminoalkyl phenyl sulfones—a novel series of 5-HT7 receptor ligands
  作者：Piotr Raubo、Margaret S. Beer、Peter A. Hunt、Ian T. Huscroft、Clare London、Josephine A. Stanton、Janusz J. Kulagowski

  DOI：10.1016/j.bmcl.2005.11.067

  日期：2006.3

  A novel series of 5-HT7 receptor ligands has been identified and evaluated, providing compounds showing a broad spectrum of functional activities and good selectivity over selected receptors and ion channels. (C) 2005 Elsevier Ltd. All rights reserved.