ethyl 2'-amino-1-benzyl-5'-cyano-6'-(1H-indol-3-yl)-2-oxospiro[indole-3,4'-pyran]-3'-carboxylate | 1239579-23-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吲哚及其衍生物
• 英文名称: ethyl 2'-amino-1-benzyl-5'-cyano-6'-(1H-indol-3-yl)-2-oxospiro[indole-3,4'-pyran]-3'-carboxylate
• CAS: 1239579-23-7
• 化学式: C₃₁H₂₄N₄O₄
• 分子量: 516.556
• InChiKey: ORNVSLPPXNHCSQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.65
• 重原子数：
  39.0
• 可旋转键数：
  5.0
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.13
• 拓扑面积：
  121.44
• 氢给体数：
  2.0
• 氢受体数：
  6.0

反应信息

• 作为产物：
  描述：

  1-苄基-1H-吲哚-2,3-二酮 、 3-(1H-吲哚-3-基)-3-氧丙腈 、 氰乙酸乙酯 在 三乙胺 作用下， 以 甲醇 为溶剂， 反应 5.0h， 以74%的产率得到ethyl 2'-amino-1-benzyl-5'-cyano-6'-(1H-indol-3-yl)-2-oxospiro[indole-3,4'-pyran]-3'-carboxylate
  参考文献：
  名称：

  One-pot multicomponent synthesis and anti-microbial evaluation of 2′-(indol-3-yl)-2-oxospiro(indoline-3,4′-pyran) derivatives

  摘要：

  A simple and efficient method for the one-pot three-component synthesis of new spirooxindoles in room temperature is described. The newly synthesized spirooxindoles were screened for anti-microbial activity and the results are good on comparison with of standard antibacterial compounds. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2010.05.025

文献信息

• One-pot multicomponent synthesis and anti-microbial evaluation of 2′-(indol-3-yl)-2-oxospiro(indoline-3,4′-pyran) derivatives
  作者：A. Nandakumar、Prakasam Thirumurugan、Paramasivan T. Perumal、P. Vembu、M.N. Ponnuswamy、P. Ramesh

  DOI：10.1016/j.bmcl.2010.05.025

  日期：2010.7

  A simple and efficient method for the one-pot three-component synthesis of new spirooxindoles in room temperature is described. The newly synthesized spirooxindoles were screened for anti-microbial activity and the results are good on comparison with of standard antibacterial compounds. (C) 2010 Elsevier Ltd. All rights reserved.