(R/S)-2-((4-phenoxyphenoxy)methyl)piperidine | 930267-79-1

• 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: (R/S)-2-((4-phenoxyphenoxy)methyl)piperidine
• 英文别名: 2-[(4-phenoxyphenoxy)methyl]piperidine
• CAS: 930267-79-1
• 化学式: C₁₈H₂₁NO₂
• 分子量: 283.37
• InChiKey: CSJNBXMUZIPBKQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.9
• 重原子数：
  21
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  30.5
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  4-苯氧基苯酚 、 hexahydro-[1,2,3]oxathiazolo[3,4-a]pyridine 1,1-dioxide 在 potassium carbonate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 25.0h， 生成 (R/S)-2-((4-phenoxyphenoxy)methyl)piperidine
  参考文献：
  名称：

  Discovery of novel leukotriene A4 hydrolase inhibitors based on piperidine and piperazine scaffolds

  摘要：

  Novel piperidine and piperazine derivatives have been designed and tested as inhibitors of LTA(4) hydrolase (LTA(4)H). Most potent compounds showed good potency in both enzymatic and functional human whole blood assay. Crystallography studies further confirmed observed structure-activity relationship and LTA(4)H binding mode for analogs from the piperidine series. (C) 2010 Published by Elsevier Ltd.

  DOI：

  10.1016/j.bmcl.2010.03.047

文献信息

• BIARYL SUBSTITUTED HETEROCYCLE INHIBITORS OF LTA4H FOR TREATING INFLAMMATION
  申请人：Sandanayaka Vincent

  公开号：US20070066820A1

  公开（公告）日：2007-03-22

  The present invention relates to a chemical genus of biaryl substituted heterocycle inhibitors of LTA4H (leukotriene A4 hydrolase) useful for the treatment and prevention and prophylaxis of inflammatory diseases and disorders. The compounds have general formula Ψ: An example is

  这项发明涉及一种化学类别的双芳基取代杂环抑制剂，用于治疗、预防和预防炎症性疾病和紊乱。这些化合物具有一般公式Ψ：一个例子是
• US7402684B2
  申请人：——

  公开号：US7402684B2

  公开（公告）日：2008-07-22
• [EN] BIARYL SUBSTITUTED HETEROCYCLE INHIBITORS OF LTA4H FOR TREATING INFLAMMATION<br/>[FR] INHIBITEURS HÉTÉROCYCLIQUES SUBSTITUÉS PAR BIARYLE DE LTA4H POUR LE TRAITEMENT D'INFLAMMATIONS
  申请人：DECODE GENETICS INC

  公开号：WO2007040681A1

  公开（公告）日：2007-04-12

  [EN] The present invention relates to a chemical genus of biaryl substituted heterocycle inhibitors of LTA4H (leukotriene A4 hydrolase) useful for the treatment and prevention and prophylaxis of inflammatory diseases and disorders. The compounds have general formula (?). An example is formula (I).
  [FR] La présente invention concerne une famille chimique d'inhibiteurs hétérocycliques substitués par des groupements biaryle de LTA4H (leukotriène A4 hydrolase) pouvant être employés dans le traitement prophylactique et thérapeutique de maladies et de troubles inflammatoires. Les composés sont de formule générale (?). La formule (I) est un exemple de composé.
• [EN] BIARYL SUBSTITUTED HETEROCYCLE INHIBITORS OF LTA4H FOR TREATING INFLAMMATION<br/>[FR] INHIBITEURS HÉTÉROCYCLIQUES DE LTA4H SUBSTITUÉS PAR BIARYLE POUR LE TRAITEMENT DES INFLAMMATIONS
  申请人：DECODE CHEMISTRY INC

  公开号：WO2007040682A1

  公开（公告）日：2007-04-12

  [EN] The present invention relates to a chemical genus of biaryl substituted heterocycle inhibitors of LTA4H (leukotriene A4 hydrolase) useful for the treatme and prevention and prophylaxis of inflammatory diseases and disorders. The compounds have general formula ? :
  [FR] La présente invention concerne un genre chimique d'inhibiteurs hétérocycliques de LTA4H substitués par biaryle (leucotriène A4 hydrolase) utiles dans le traitement, la prévention et la prophylaxie de pathologies et troubles inflammatoires. Les composés ont la formule générale ? :
• Discovery of novel leukotriene A4 hydrolase inhibitors based on piperidine and piperazine scaffolds
  作者：Vincent Sandanayaka、Bjorn Mamat、Nikhil Bhagat、Louis Bedell、Gudrun Halldorsdottir、Heida Sigthorsdottir、Þorkell Andrésson、Alex Kiselyov、Mark Gurney、Jasbir Singh

  DOI：10.1016/j.bmcl.2010.03.047

  日期：2010.5

  Novel piperidine and piperazine derivatives have been designed and tested as inhibitors of LTA(4) hydrolase (LTA(4)H). Most potent compounds showed good potency in both enzymatic and functional human whole blood assay. Crystallography studies further confirmed observed structure-activity relationship and LTA(4)H binding mode for analogs from the piperidine series. (C) 2010 Published by Elsevier Ltd.