1-Boc-4-(aminomethyl)-4-ethylpiperidine | 1158758-98-5

• 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: 1-Boc-4-(aminomethyl)-4-ethylpiperidine
• 英文别名: tert-butyl 4-(aminomethyl)-4-ethylpiperidine-1-carboxylate
• CAS: 1158758-98-5
• 化学式: C₁₃H₂₆N₂O₂
• 分子量: 242.362
• InChiKey: LTCVVNLACZFQSW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  17
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.92
• 拓扑面积：
  55.6
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  三氟甲磺酸酐 、 1-Boc-4-(aminomethyl)-4-ethylpiperidine 在 三乙胺 作用下， 以 二氯甲烷 为溶剂， 生成
  参考文献：
  名称：

  Non-aromatic A-ring replacement in the triaryl bis-sulfone CB2 receptor inhibitors

  摘要：

  The triaryl bis-sulfone 1 was modified by converting the aryl A-ring to a piperidine ring. The piperidine ring was further elaborated to a spirocyclopropyl piperidine moiety. The effect on CB2 binding potency, rat calcium channel affinity, and CYP 2C9 inhibition is described. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2009.11.084
• 作为产物：
  描述：

  tert-butyl 4-cyano-4-ethylpiperidine-1-carboxylate 在 氨 、 氢气 作用下， 以 甲醇 、 乙醇 为溶剂， 反应 48.0h， 生成 1-Boc-4-(aminomethyl)-4-ethylpiperidine
  参考文献：
  名称：

  Non-aromatic A-ring replacement in the triaryl bis-sulfone CB2 receptor inhibitors

  摘要：

  The triaryl bis-sulfone 1 was modified by converting the aryl A-ring to a piperidine ring. The piperidine ring was further elaborated to a spirocyclopropyl piperidine moiety. The effect on CB2 binding potency, rat calcium channel affinity, and CYP 2C9 inhibition is described. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2009.11.084

文献信息

• [EN] ANTI-INFLUENZA VIRUS COMPOUND, PREPARATION METHOD AND USE THEREOF<br/>[FR] COMPOSÉ CONTRE LE VIRUS DE LA GRIPPE, SON PROCÉDÉ DE PRÉPARATION ET SON UTILISATION<br/>[ZH] 抗流感病毒化合物及其制备方法和用途
  申请人：SICHUAN HAISCO PHARMACEUTICAL CO LTD

  公开号：WO2021032209A1

  公开（公告）日：2021-02-25

  涉及作为Hemagglutinin抑制剂的式(I-a)化合物、其异构体或其药学上可接受的盐，及其制备方法。所述化合物用于制备治疗与Hemagglutinin相关的疾病的药物。
• Non-aromatic A-ring replacement in the triaryl bis-sulfone CB2 receptor inhibitors
  作者：Eric J. Gilbert、Guowei Zhou、Michael K.C. Wong、Ling Tong、Bandarpalle B. Shankar、Chunli Huang、Joseph Kelly、Brian J. Lavey、Stuart W. McCombie、Lei Chen、Razia Rizvi、Youhao Dong、Youheng Shu、Joseph A. Kozlowski、Neng-Yang Shih、R. William Hipkin、Waldemar Gonsiorek、Asra Malikzay、Charles A. Lunn、Len Favreau、Daniel J. Lundell

  DOI：10.1016/j.bmcl.2009.11.084

  日期：2010.1

  The triaryl bis-sulfone 1 was modified by converting the aryl A-ring to a piperidine ring. The piperidine ring was further elaborated to a spirocyclopropyl piperidine moiety. The effect on CB2 binding potency, rat calcium channel affinity, and CYP 2C9 inhibition is described. (C) 2009 Elsevier Ltd. All rights reserved.