1,3-Dimethyl-7-(3-methylbut-2-enyl)-2,4-dioxopyrrolo[2,3-d]pyrimidine-6-carbaldehyde | 131599-10-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯并嘧啶类
• 英文名称: 1,3-Dimethyl-7-(3-methylbut-2-enyl)-2,4-dioxopyrrolo[2,3-d]pyrimidine-6-carbaldehyde
• CAS: 131599-10-5
• 化学式: C₁₄H₁₇N₃O₃
• 分子量: 275.307
• InChiKey: LSUNMLMXUFRPKP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  20
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  62.6
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  1,3-Dimethyl-7-(3-methylbut-2-enyl)-2,4-dioxopyrrolo[2,3-d]pyrimidine-6-carbaldehyde 在 sodium hypochlorite 、 羟胺 作用下， 生成 3,5,13,13-tetramethyl-12-oxa-1,3,5,11-tetrazatetracyclo[7.6.0.02,7.010,14]pentadeca-2(7),8,10-triene-4,6-dione
  参考文献：
  名称：

  Bhuyan; Boruah; Sandhu, Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1990, vol. 29, # 10, p. 901 - 903

  摘要：

  DOI：
• 作为产物：
  描述：

  1-溴-3-甲基-2-丁烯 、 1,3-dimethyl-2,4-dioxo-1H-pyrrolo[2,3-d]pyrimidine-6-carbaldehyde 在 potassium carbonate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 12.0h， 生成 1,3-Dimethyl-7-(3-methylbut-2-enyl)-2,4-dioxopyrrolo[2,3-d]pyrimidine-6-carbaldehyde
  参考文献：
  名称：

  方便的微波辅助，分子内杂Diels–Alder合成吡咯并[2,3 - d ]嘧啶-吡喃并[5,6 - c ]香豆素/ [6,5- c ]色酮衍生物反应

  摘要：

  快速合成吡咯并[2,3- d ]嘧啶环吡喃并[ 5,6- c ]香豆素/ [6,5- c ]色酮衍生物是通过分子内多米诺骨牌异狄尔斯-阿尔德反应（微波）以高收率完成的。在无溶剂，固相支持的条件下进行辐照。

  DOI：

  10.1016/j.tetlet.2008.01.059

文献信息

• Indium chloride catalyzed intramolecular cyclization of N-aryl imines: synthesis of pyrrolo[2,3-d]pyrimidine annulated tetrahydroquinoline derivatives
  作者：Ekambaram Ramesh、Raghavachary Raghunathan

  DOI：10.1016/j.tetlet.2008.02.105

  日期：2008.4

  The intramolecular aza Diels-Alder cyclization reaction of aldimines derived from aromatic amines and N-prenyl/cinnamyl derivatives of pyrrolo[2,3-d]pyrimidine were efficiently catalyzed by InCl(3) to afford the corresponding tetrahydroquinoline derivatives in good yields. (c) 2008 Elsevier Ltd. All rights reserved.
• Synthesis and antibacterial property of quinolines with potent DNA gyrase activity
  作者：Ekambaram Ramesh、Rathna Durga R.S. Manian、Ragavachary Raghunathan、Shilpakala Sainath、Malathi Raghunathan

  DOI：10.1016/j.bmc.2008.11.058

  日期：2009.1

  Synthesis of a series of novel tetrahydroquinoline annulated heterocycles has been accomplished by intramolecular imino and bisimino Diels-Alder reaction. These compounds were evaluated for their antibacterial activity. All the synthetic compounds, exhibited good antibacterial activity against microorganisms of which one of them 7 was found to be as active as the antibiotic ciplofloxacin and is found to have MIC value of 2.5 mg/mL against Escherichia coli. (C) 2008 Elsevier Ltd. All rights reserved.
• BHUYAN, PULAKJYOTI;BORUAH, ROMESH CHANDRA;SANDHU, JAGIR S., INDIAN J. CHEM. B , 29,(1990) N0, C. 901-903
  作者：BHUYAN, PULAKJYOTI、BORUAH, ROMESH CHANDRA、SANDHU, JAGIR S.

  DOI：——

  日期：——