(R)-tert-butyl 2-{[tert-butyl(dimethyl)silyl]oxy}-1-(hydroxymethyl)ethylcarbamate | 226943-68-6

• 分子结构分类: 有机化合物 - 有机金属化合物 - 有机类金属化合物
• 英文名称: (R)-tert-butyl 2-{[tert-butyl(dimethyl)silyl]oxy}-1-(hydroxymethyl)ethylcarbamate
• CAS: 226943-68-6
• 化学式: C₁₄H₃₁NO₄Si
• 分子量: 305.49
• InChiKey: OKOFEVZCVGPZCQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.89
• 重原子数：
  20.0
• 可旋转键数：
  5.0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.93
• 拓扑面积：
  67.79
• 氢给体数：
  2.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  甲基磺酰氯 、 (R)-tert-butyl 2-{[tert-butyl(dimethyl)silyl]oxy}-1-(hydroxymethyl)ethylcarbamate 在 三乙胺 作用下， 以 二氯甲烷 为溶剂， 生成
  参考文献：
  名称：

  Immucillins in custom catalytic-site cavities

  摘要：

  Neighboring-group participation in the reaction catalyzed by purine nucleoside phosphorylase involves a compression mode between the 5'- and 4'-ribosyl oxygens, facilitated by His257. The His257Gly mutant opens a space in the catalytic site. Hydrophobic 5'-substituted Immucillins are transition-state analogue inhibitors of this mutant enzyme. Dissociation constants as low as 2 pM are achieved, with K-m/K-d as high as 400,000,000. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2008.08.047
• 作为产物：
  描述：

  1-O-(tert-butyldimethylsilyl)-2-[(tert-butoxycarbonyl)amino]-3-O-(tetrahydropyranyl)-L-propan-1,3-diol 在 碘 作用下， 以 甲醇 为溶剂， 反应 3.0h， 以87%的产率得到(R)-tert-butyl 2-{[tert-butyl(dimethyl)silyl]oxy}-1-(hydroxymethyl)ethylcarbamate
  参考文献：
  名称：

  甲醇中碘脱保护四氢吡喃醚的简便方法

  摘要：

  摘要 描述了一种在甲醇中使用碘对四氢吡喃基和 4,4'-二甲氧基三苯甲基醚脱保护的简单有效方法。

  DOI：

  10.1080/00397919908086457

文献信息

• [EN] SUBSTITUTED 4,5,6,7-TETRAHYDRO-PYRAZOLO[1,5-a]PYRAZINE DERIVATIVES AND 5,6,7,8-TETRAHYDRO-4H-PYRAZOLO[1,5-a][1,4]DIAZEPINE DERIVATIVES AS ROS1 INHIBITORS<br/>[FR] DÉRIVÉS 4,5,6,7-TÉTRAHYDRO-PYRAZOLO[1,5-A]PYRAZINE SUBSTITUÉS ET DÉRIVÉS 5,6,7,8-TÉTRAHYDRO-4H-PYRAZOLO[1,5-A][1,4]DIAZÉPINE UTILISÉS COMME INHIBITEURS DE ROS1
  申请人：JANSSEN PHARMACEUTICA NV

  公开号：WO2015144799A1

  公开（公告）日：2015-10-01

  The present invention relates to substituted 4,5,6,7-tetrahydro-pyrazolo[1,5-a]pyrazine derivatives and 5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine derivatives of formula (I) wherein the variables have the meaning defined in the claims. The compounds according to the present invention are useful as ROS 1 inhibitors. The invention further relates to processes for preparing such novel compounds, pharmaceutical compositions comprising said compounds as an active ingredient as well as the use of said compounds as a medicament.

  本发明涉及取代的4,5,6,7-四氢吡唑并[1,5-a]吡嗪衍生物和5,6,7,8-四氢-4H-吡唑并[1,5-a][1,4]二氮杂环衍生物的公式(I)中的变量具有权利要求中定义的含义。根据本发明的化合物可用作ROS 1抑制剂。本发明还涉及制备这种新化合物的方法，包含所述化合物作为活性成分的药物组合物，以及将所述化合物用作药物的用途。
• <i>O</i>-(Benzotriazol-1-yl)-N,N,N′,N′-tetramethyluronium Tetrafluoroborate (TBTU): A New Reagent for the Cleavage of Tetrahydropyranyl, Silyl and 4,4′-Dimethoxytrityl Ethers
  作者：Kanda S. Ramasamy、Devron Averett

  DOI：10.1055/s-1999-2724

  日期：1999.6

  A new reagent for the cleavage of tetrahydropyranyl, silyl and 4,4′-dimethoxytrityl ethers is described.

  描述了一种用于裂解四氢吡喃基、硅基和 4,4′-二甲氧基三苯甲基醚的新试剂。
• Immucillins in custom catalytic-site cavities
  作者：Andrew S. Murkin、Keith Clinch、Jennifer M. Mason、Peter C. Tyler、Vern L. Schramm

  DOI：10.1016/j.bmcl.2008.08.047

  日期：2008.11

  Neighboring-group participation in the reaction catalyzed by purine nucleoside phosphorylase involves a compression mode between the 5'- and 4'-ribosyl oxygens, facilitated by His257. The His257Gly mutant opens a space in the catalytic site. Hydrophobic 5'-substituted Immucillins are transition-state analogue inhibitors of this mutant enzyme. Dissociation constants as low as 2 pM are achieved, with K-m/K-d as high as 400,000,000. (C) 2008 Elsevier Ltd. All rights reserved.
• A Simple and Convenient Method for the Deprotection of Tetrahydropyranyl Ether Using Iodine in Methanol
  作者：Kanda S. Ramasamy、Rajanikanth Bandaru、Devron Averett

  DOI：10.1080/00397919908086457

  日期：1999.8

  Abstract A simple and efficient method for the -deprotection of tetrahydropyranyl and 4,4′-dimethoxytrityl ethers using iodine in methanol is described.

  摘要 描述了一种在甲醇中使用碘对四氢吡喃基和 4,4'-二甲氧基三苯甲基醚脱保护的简单有效方法。