(1-Naphthalen-2-ylsulfonylpiperidin-4-yl)methanamine | 392691-19-9

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: (1-Naphthalen-2-ylsulfonylpiperidin-4-yl)methanamine
• CAS: 392691-19-9
• 化学式: C₁₆H₂₀N₂O₂S
• 分子量: 304.413
• InChiKey: QXFHHPMCCQARRO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.8
• 重原子数：
  21
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  71.8
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  甘氨熊胆酸 、 (1-Naphthalen-2-ylsulfonylpiperidin-4-yl)methanamine 以 甲醇 为溶剂， 反应 18.0h， 生成 (2S)-1-(9H-Carbazol-4-yloxy)-3-{[1-(naphthalene-2-sulfonyl)-piperidin-4-ylmethyl]-amino}-propan-2-ol
  参考文献：
  名称：

  Novel substituted 4-aminomethylpiperidines as potent and selective human β3-agonists. Part 1: aryloxypropanolaminomethylpiperidines

  摘要：

  The synthesis and SAR of a series of human beta(3) adrenoreceptor agonists based on a template derived from a common pharmacophore coupled with 4-aminomethylpiperidine is described. Potent and selective agents were identified such as 26 that was in vitro active in CHO cells expressing human beta(3)-AR (EC50 = 49 nNl, IA = 1.1), and in vivo active in a transgenic mouse model. (C) 2002 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(02)00607-8
• 作为产物：
  描述：

  4-Boc-氨甲基哌啶 在 盐酸 、 N,N-二异丙基乙胺 作用下， 以 四氢呋喃 、 1,4-二氧六环 为溶剂， 生成 (1-Naphthalen-2-ylsulfonylpiperidin-4-yl)methanamine
  参考文献：
  名称：

  Novel substituted 4-aminomethylpiperidines as potent and selective human β3-agonists. Part 1: aryloxypropanolaminomethylpiperidines

  摘要：

  The synthesis and SAR of a series of human beta(3) adrenoreceptor agonists based on a template derived from a common pharmacophore coupled with 4-aminomethylpiperidine is described. Potent and selective agents were identified such as 26 that was in vitro active in CHO cells expressing human beta(3)-AR (EC50 = 49 nNl, IA = 1.1), and in vivo active in a transgenic mouse model. (C) 2002 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(02)00607-8

文献信息

• Cannabinoid receptor ligands
  申请人：Schering Corporation

  公开号：US20040010013A1

  公开（公告）日：2004-01-15

  There are disclosed compounds of the formula I: 1 or a pharmaceutically acceptable salt of the compound, which exhibit anti-inflammatory and immunomodulatory activity. Also disclosed are pharmaceutical compositions containing said compounds.

  公开了以下式I的化合物： 1 或者该化合物的药用盐，具有抗炎和免疫调节活性。还公开了含有这些化合物的药物组合物。
• AMINO-DERIVATIVES AS NOVEL INHIBITORS OF HISTONE DEACETYLASE
  申请人：Janssen Pharmaceutica NV

  公开号：EP1485370B1

  公开（公告）日：2009-03-04
• US7645774B2
  申请人：——

  公开号：US7645774B2

  公开（公告）日：2010-01-12
• Novel substituted 4-aminomethylpiperidines as potent and selective human β3-agonists. Part 1: aryloxypropanolaminomethylpiperidines
  作者：Robert J. Steffan、Mark A. Ashwell、William R. Solvibile、Edward Matelan、Elwood Largis、Stella Han、Jeffery Tillet、Ruth Mulvey

  DOI：10.1016/s0960-894x(02)00607-8

  日期：2002.10

  The synthesis and SAR of a series of human beta(3) adrenoreceptor agonists based on a template derived from a common pharmacophore coupled with 4-aminomethylpiperidine is described. Potent and selective agents were identified such as 26 that was in vitro active in CHO cells expressing human beta(3)-AR (EC50 = 49 nNl, IA = 1.1), and in vivo active in a transgenic mouse model. (C) 2002 Elsevier Science Ltd. All rights reserved.