tert-butyl N-[5-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-7-oxo-4-phenylmethoxy-8H-pyrimido[4,5-d]pyrimidin-2-yl]-N-methylcarbamate | 1268383-04-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪类
• 英文名称: tert-butyl N-[5-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-7-oxo-4-phenylmethoxy-8H-pyrimido[4,5-d]pyrimidin-2-yl]-N-methylcarbamate
• CAS: 1268383-04-5
• 化学式: C₂₉H₃₈N₆O₈
• 分子量: 598.656
• InChiKey: LTIQUUPJBDTOHD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.5
• 重原子数：
  43
• 可旋转键数：
  11
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.48
• 拓扑面积：
  162
• 氢给体数：
  1
• 氢受体数：
  10

反应信息

• 作为反应物：
  描述：

  tert-butyl N-[5-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-7-oxo-4-phenylmethoxy-8H-pyrimido[4,5-d]pyrimidin-2-yl]-N-methylcarbamate 、 1-Α-氯-3,5-二-O-对甲苯甲酰基-2-脱氧-D-呋喃核糖 在 sodium hydride 作用下， 以 四氢呋喃 、 oil 为溶剂， 反应 1.0h， 生成 (2R,3S,5R)-5-(5-(benzyloxy)-4-(bis(tert-butoxycarbonyl)amino)-7-((tert-butoxycarbonyl)(methyl)amino)-2-oxopyrimido[4,5-d]pyrimidin-1(2H)-yl)-2-(((4-methylbenzoyl)oxy)methyl)tetrahydrofuran-3-yl 4-methylbenzoate 、
  参考文献：
  名称：

  Synthesis of a β-glycoside functionalized GΛC motif for self-assembly into rosette nanotubes with predefined length

  摘要：

  Progress toward the synthesis of guanine cytosine (G Lambda C) oligonucleotides for the spontaneous self-assembly of rosette nanotubes (RNTs) with predefined length is described. Highlighted is the synthesis of the beta-glycoside functionalized G Lambda C base along with a new nitrogen protecting group strategy that is compatible with Boc and Bn groups. Crown Copyright (C) 2010 Published by Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2010.11.122
• 作为产物：
  描述：

  4-(but-3-enylamino)-6-chloro-2-(methylamino)pyrimidine-5-carbaldehyde 在 4-二甲氨基吡啶 、 sodium periodate 、 四氧化锇 、 盐酸羟胺 、 氨 、 sodium hydride 、 potassium hydrogencarbonate 、 N-甲基吗啉氧化物 、 三乙胺 、 三氟乙酸酐 作用下， 以 四氢呋喃 、 甲醇 、 二氯甲烷 、 水 、 1,2-二氯乙烷 、 丙酮 、 叔丁醇 为溶剂， 反应 28.0h， 生成 tert-butyl N-[5-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-7-oxo-4-phenylmethoxy-8H-pyrimido[4,5-d]pyrimidin-2-yl]-N-methylcarbamate
  参考文献：
  名称：

  Synthesis of a β-glycoside functionalized GΛC motif for self-assembly into rosette nanotubes with predefined length

  摘要：

  Progress toward the synthesis of guanine cytosine (G Lambda C) oligonucleotides for the spontaneous self-assembly of rosette nanotubes (RNTs) with predefined length is described. Highlighted is the synthesis of the beta-glycoside functionalized G Lambda C base along with a new nitrogen protecting group strategy that is compatible with Boc and Bn groups. Crown Copyright (C) 2010 Published by Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2010.11.122

文献信息

• Synthesis of a β-glycoside functionalized GΛC motif for self-assembly into rosette nanotubes with predefined length
  作者：Rachel L. Beingessner、Julian A. Diaz、Usha D. Hemraz、Hicham Fenniri

  DOI：10.1016/j.tetlet.2010.11.122

  日期：2011.2

  Progress toward the synthesis of guanine cytosine (G Lambda C) oligonucleotides for the spontaneous self-assembly of rosette nanotubes (RNTs) with predefined length is described. Highlighted is the synthesis of the beta-glycoside functionalized G Lambda C base along with a new nitrogen protecting group strategy that is compatible with Boc and Bn groups. Crown Copyright (C) 2010 Published by Elsevier Ltd. All rights reserved.