ethyl 4-nitro-2,5-diphenyl-1H-pyrrole-3-carboxylate | 86625-47-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯
• 英文名称: ethyl 4-nitro-2,5-diphenyl-1H-pyrrole-3-carboxylate
• CAS: 86625-47-0
• 化学式: C₁₉H₁₆N₂O₄
• 分子量: 336.347
• InChiKey: NJHWGZCCWFPVJL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.43
• 重原子数：
  25.0
• 可旋转键数：
  5.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.11
• 拓扑面积：
  85.23
• 氢给体数：
  1.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  ethyl 4-nitro-2,5-diphenyl-1H-pyrrole-3-carboxylate 在 palladium on activated charcoal 氢气 作用下， 以 乙醇 为溶剂， 以69%的产率得到4-Amino-2,5-diphenyl-1H-pyrrole-3-carboxylic acid ethyl ester
  参考文献：
  名称：

  Dattolo, Gaetano; Cirrincione, Girolamo; Almerico, Anna Maria, Heterocycles, 1983, vol. 20, # 5, p. 829 - 837

  摘要：

  DOI：
• 作为产物：
  描述：

  2,5-二苯基-1H-吡咯-3-羧酸乙酯 在 硝酸 、 乙酸酐 作用下， 以 硝基甲烷 为溶剂， 以47%的产率得到ethyl 4-nitro-2,5-diphenyl-1H-pyrrole-3-carboxylate
  参考文献：
  名称：

  Dattolo, Gaetano; Cirrincione, Girolamo; Almerico, Anna Maria, Heterocycles, 1983, vol. 20, # 5, p. 829 - 837

  摘要：

  DOI：

文献信息

• Pyrrolo[3,4-<i>e</i>][1,2,3]triazolo[1,5-<i>a</i>]pyrimidine and pyrrolo[3,4-<i>d</i>] [1,2,3]triazolo[1,5-<i>a</i>]pyrimidine. New tricyclic ring systems of biological interest
  作者：Antonino Lauria、Patrizia Diana、Paola Barraja、Anna Maria Almerico、Girolamo Cirrincione、Gaetano Dattolo

  DOI：10.1002/jhet.5570370413

  日期：2000.7

  Derivatives of the new ring system pyrrolo[3,4-e][1,2,3] triazolo[1,5-a]pyrimidine 6 were prepared in high yields in one step by reaction of 3-azidopyrrole 3 and substituted acetonitriles. Compound 6b rearranged, upon heating in dimethyl sulfoxide in the presence of water, to pyrrolo[3,4-d][1,2,3]triazolo-[1,5-a]pyrimidine 7.

  通过3-叠氮基吡咯3和取代的乙腈的一步反应，高产率地制备了新的环系统吡咯并[3,4- e ] [1,2,3]三唑并[1,5- a ]嘧啶6的衍生物。在水存在下在二甲基亚砜中加热时，化合物6b重排为吡咯并[3,4- d ] [1,2,3]三唑并-[1,5- a ]嘧啶7。
• Cirrincione; Almerico; Dattolo, Il Farmaco, 1992, vol. 47, # 12, p. 1555 - 1562
  作者：Cirrincione、Almerico、Dattolo、Aiello、Grimaudo、Diana、Misuraca

  DOI：——

  日期：——
• Glycosidopyrroles Part 1. Acyclic derivatives: 1-(2-hydroxyethoxy) methylpyrroles as potential anti-viral agents
  作者：Anna Maria Almerico、Patrizia Diana、Paola Barraja、Gaetano Dattolo、Francesco Mingoia、Anna Giulia Loi、Franca Scintu、Carlo Milia、Ivana Puddu、Paolo La Colla

  DOI：10.1016/s0014-827x(97)00002-5

  日期：1998.1

  Acyclic glycosidopyrroles of type 1, synthesized in good overall yields, were evaluated for anti-viral activity. Compound 10i was found to inhibit the HIV-1 replication at concentrations that were very close to those cytotoxic for MT-4 cells. Compounds 10a,f,i inhibited both strains HSV-1 and HSV-2 at concentrations slightly below those cytotoxic for Vero cells. However for this series of glycosidopyrroles some relationship between calculated log P values and the observed cytotoxicity was found. (C) 1998 Elsevier Science S.A.
• Almerico; Diana; Barraja, Il Farmaco, 1997, vol. 52, # 11, p. 667 - 672
  作者：Almerico、Diana、Barraja、Dattolo

  DOI：——

  日期：——
• DATTOLO, G.;CIRRINCIONE, G.;ALMERICO, A. M.;PRESTI, G.;AIELLO, E., HETEROCYCLES, 1983, 20, N 5, 829-837
  作者：DATTOLO, G.、CIRRINCIONE, G.、ALMERICO, A. M.、PRESTI, G.、AIELLO, E.

  DOI：——

  日期：——