2-甲基-2-丙基(2E)-2-(3-呋喃基亚甲基)肼羧酸酯 | 150767-01-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 杂芳族化合物
• 中文名称: 2-甲基-2-丙基(2E)-2-(3-呋喃基亚甲基)肼羧酸酯
• 英文名称: N-(1-aza-2-(3-furyl)vinyl)(tert-butoxy)-carboxamide
• 英文别名: 1,1-Dimethylethyl 2-(3-furanylmethylene)hydrazinecarboxylate；tert-butyl N-(furan-3-ylmethylideneamino)carbamate
• CAS: 150767-01-4
• 化学式: C₁₀H₁₄N₂O₃
• 分子量: 210.233
• InChiKey: WGKOWOFNGIUJBJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.6
• 重原子数：
  15
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  63.8
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  2-甲基-2-丙基(2E)-2-(3-呋喃基亚甲基)肼羧酸酯 在 sodium cyanoborohydride 、 溶剂黄146 作用下， 以 四氢呋喃 、 甲醇 为溶剂， 反应 4.08h， 生成 C₂₅H₂₇ClN₄O₆
  参考文献：
  名称：

  Pyridazinoquinolinetriones as NMDA Glycine-Site Antagonists with Oral Antinociceptive Activity in a Model of Neuropathic Pain

  摘要：

  A series of 7-chloro-2,3-dihydro-2-[1-(pyridinyl)alkyl]-pyridazino[4,5-b]quinoline-1,4,10(5H)-triones were synthesized and found to have potent activity at the glycine site of the NMDA receptor. In some cases, these compounds possessed poor aqueous solubility that may have contributed to poor rat oral bioavailability. Subsequently, compounds have been identified with improved aqueous solubility and oral bioavailability. Several of these compounds were examined in a rat chronic constrictive injury (CCI) model of neuropathic pain and found to have potent activity when dosed orally.

  DOI：

  10.1021/jm060212s
• 作为产物：
  描述：

  3-糠醛 、 肼基甲酸叔丁酯 生成 2-甲基-2-丙基(2E)-2-(3-呋喃基亚甲基)肼羧酸酯
  参考文献：
  名称：

  轻松合成含有新型伪对称二肽等排体的有效HIV-1蛋白酶抑制剂

  摘要：

  通过用各种取代的肼将受保护的环氧化物开环，合成了一系列含有新型伪对称二肽等位基因3的有效的HIV-1蛋白酶抑制剂。

  DOI：

  10.1039/c39930001052

文献信息

• CN115322151
  申请人：——

  公开号：——

  公开（公告）日：——
• Pyridazinoquinolinetriones as NMDA Glycine-Site Antagonists with Oral Antinociceptive Activity in a Model of Neuropathic Pain
  作者：Thomas M. Bare、Dean G. Brown、Carey L. Horchler、Megan Murphy、Rebecca A. Urbanek、Vernon Alford、Christine Barlaam、Martin C. Dyroff、James B. Empfield、Janet M. Forst、Keith J. Herzog、Richard A. Keith、Alan S. Kirschner、Chi-Ming C. Lee、Joseph Lewis、Frances M. McLaren、Kathy L. Neilson、Gary B. Steelman、Shephali Trivedi、Edward P. Vacek、Wenhua Xiao

  DOI：10.1021/jm060212s

  日期：2007.6.1

  A series of 7-chloro-2,3-dihydro-2-[1-(pyridinyl)alkyl]-pyridazino[4,5-b]quinoline-1,4,10(5H)-triones were synthesized and found to have potent activity at the glycine site of the NMDA receptor. In some cases, these compounds possessed poor aqueous solubility that may have contributed to poor rat oral bioavailability. Subsequently, compounds have been identified with improved aqueous solubility and oral bioavailability. Several of these compounds were examined in a rat chronic constrictive injury (CCI) model of neuropathic pain and found to have potent activity when dosed orally.
• Facile synthesis of potent HIV-1 protease inhibitors containing a novel pseudo-symmetric dipeptide isostere
  作者：Hing L. Sham、David A. Betebenner、Chen Zhao、Norman E. Wideburg、Ayda Saldivar、Dale J. Kempf、Jacob J. Plattner、Daniel W. Norbeck

  DOI：10.1039/c39930001052

  日期：——

  A series of potent inhibitors of the HIV-1 protease containing a novel pseudo-symmetric dipeptide isostere 3 was synthesized via ring opening of a protected epoxide with various substituted hydrazines.

  通过用各种取代的肼将受保护的环氧化物开环，合成了一系列含有新型伪对称二肽等位基因3的有效的HIV-1蛋白酶抑制剂。