tert-butyl N-[(1R,2R)-2-[[4-[[(1R,2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexyl]amino]-4-oxobutanoyl]amino]cyclohexyl]carbamate | 323187-49-1

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: tert-butyl N-[(1R,2R)-2-[[4-[[(1R,2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexyl]amino]-4-oxobutanoyl]amino]cyclohexyl]carbamate
• CAS: 323187-49-1
• 化学式: C₂₆H₄₆N₄O₆
• 分子量: 510.674
• InChiKey: PIUZHABJXGOWMO-UAFMIMERSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  36
• 可旋转键数：
  11
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.85
• 拓扑面积：
  135
• 氢给体数：
  4
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  tert-butyl N-[(1R,2R)-2-[[4-[[(1R,2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexyl]amino]-4-oxobutanoyl]amino]cyclohexyl]carbamate 在 三氟乙酸 作用下， 以 乙醇 、 二氯甲烷 为溶剂， 反应 2.0h， 生成 N,N'-Bis-((1R,2R)-2-{[1-phenyl-meth-(E)-ylidene]-amino}-cyclohexyl)-succinamide
  参考文献：
  名称：

  Amide catalysts with tetradentate ligands and the asymmetric transfer hydrogenation of carbonyl compounds

  摘要：

  Amidic tetradentate catalysts comprising two trans-1,2-cyclohexanediamine units linked via a dicarbonyl spacer are shown to provide useful enantiomeric excesses in the asymmetric transfer hydrogenation from propan-2-ol to aromatic ketones. N-Benzylation of the terminal amino groups results, in several cases, in reversal of the absolute configuration of the major product. (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(00)01621-x
• 作为产物：
  描述：

  二碳酸二叔丁酯 在 三乙胺 作用下， 以 乙醇 、 二氯甲烷 为溶剂， 反应 32.0h， 生成 tert-butyl N-[(1R,2R)-2-[[4-[[(1R,2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexyl]amino]-4-oxobutanoyl]amino]cyclohexyl]carbamate
  参考文献：
  名称：

  Amide catalysts with tetradentate ligands and the asymmetric transfer hydrogenation of carbonyl compounds

  摘要：

  Amidic tetradentate catalysts comprising two trans-1,2-cyclohexanediamine units linked via a dicarbonyl spacer are shown to provide useful enantiomeric excesses in the asymmetric transfer hydrogenation from propan-2-ol to aromatic ketones. N-Benzylation of the terminal amino groups results, in several cases, in reversal of the absolute configuration of the major product. (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(00)01621-x

文献信息

• Amide catalysts with tetradentate ligands and the asymmetric transfer hydrogenation of carbonyl compounds
  作者：Charles M Marson、Ido Schwarz

  DOI：10.1016/s0040-4039(00)01621-x

  日期：2000.11

  Amidic tetradentate catalysts comprising two trans-1,2-cyclohexanediamine units linked via a dicarbonyl spacer are shown to provide useful enantiomeric excesses in the asymmetric transfer hydrogenation from propan-2-ol to aromatic ketones. N-Benzylation of the terminal amino groups results, in several cases, in reversal of the absolute configuration of the major product. (C) 2000 Elsevier Science Ltd. All rights reserved.