tert-butyl N-[(1R,3S)-3-(4-cyano-4-phenylpiperidin-1-yl)cyclopentyl]carbamate | 225641-88-3

• 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: tert-butyl N-[(1R,3S)-3-(4-cyano-4-phenylpiperidin-1-yl)cyclopentyl]carbamate
• CAS: 225641-88-3
• 化学式: C₂₂H₃₁N₃O₂
• 分子量: 369.507
• InChiKey: NUYZKPILTBAJMB-MOPGFXCFSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  27
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.64
• 拓扑面积：
  65.4
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  tert-butyl N-[(1R,3S)-3-(4-cyano-4-phenylpiperidin-1-yl)cyclopentyl]carbamate 在 盐酸 作用下， 以 乙酸乙酯 为溶剂， 生成 1-((1S,3R)-3-Amino-cyclopentyl)-4-phenyl-piperidine-4-carbonitrile
  参考文献：
  名称：

  Preparation and evaluation of 1,3-diaminocyclopentane-linked dihydropyrimidinone derivatives as selective α1a-receptor antagonists

  摘要：

  Several 1,3-diaminocyclopentane linked alpha(1a)-receptor antagonists were prepared using a divergent chemical strategy that allows for rapid analysis of all stereochemical permutations for their effect on alpha(1)-receptor binding. (C) 2000 Published by Elsevier Science Ltd.

  DOI：

  10.1016/s0960-894x(00)00374-7
• 作为产物：
  描述：

  [(1R,3S)-3-羟基环戊基]氨基甲酸叔丁酯 在 草酰氯 、 sodium cyanoborohydride 、 溶剂黄146 、 二甲基亚砜 、 三乙胺 作用下， 以 四氢呋喃 、 甲醇 、 二氯甲烷 为溶剂， 生成 tert-butyl N-[(1R,3S)-3-(4-cyano-4-phenylpiperidin-1-yl)cyclopentyl]carbamate
  参考文献：
  名称：

  Preparation and evaluation of 1,3-diaminocyclopentane-linked dihydropyrimidinone derivatives as selective α1a-receptor antagonists

  摘要：

  Several 1,3-diaminocyclopentane linked alpha(1a)-receptor antagonists were prepared using a divergent chemical strategy that allows for rapid analysis of all stereochemical permutations for their effect on alpha(1)-receptor binding. (C) 2000 Published by Elsevier Science Ltd.

  DOI：

  10.1016/s0960-894x(00)00374-7

文献信息

• Preparation and evaluation of 1,3-diaminocyclopentane-linked dihydropyrimidinone derivatives as selective α1a-receptor antagonists
  作者：James C Barrow、Kristen L Glass、Harold G Selnick、Roger M Freidinger、Raymond S.L Chang、Stacey S O'Malley、Carla Woyden

  DOI：10.1016/s0960-894x(00)00374-7

  日期：2000.9

  Several 1,3-diaminocyclopentane linked alpha(1a)-receptor antagonists were prepared using a divergent chemical strategy that allows for rapid analysis of all stereochemical permutations for their effect on alpha(1)-receptor binding. (C) 2000 Published by Elsevier Science Ltd.