methyl 5,6-dimethoxy-3-(3,4-dimethoxyphenyl)indole-2-carboxylate

• 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: methyl 5,6-dimethoxy-3-(3,4-dimethoxyphenyl)indole-2-carboxylate
• 英文别名: Methyl 3-(3,4-dimethoxyphenyl)-5,6-dimethoxy-1H-indole-2-carboxylate
• 化学式: C₂₀H₂₁NO₆
• 分子量: 371.39
• InChiKey: KFZGADIVBKXPKF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.7
• 重原子数：
  27
• 可旋转键数：
  7
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  79
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  methyl 5,6-dimethoxy-3-(3,4-dimethoxyphenyl)indole-2-carboxylate 、 碘乙烷 以 N,N-二甲基甲酰胺 为溶剂， 以77%的产率得到methyl 1-ethyl-5,6-dimethoxy-3-(3,4-dimethoxyphenyl)indole-2-carboxylate
  参考文献：
  名称：

  Indole derivatives, their production and use

  摘要：

  一种用于抑制骨吸收的制剂，包括公式（I）的吲哚衍生物：##STR1## 其中A和B的每个环均可选择性地被取代，R是氢原子、较低的烷基或酰基，A是羟甲基基团或酯化或酰胺化的羧基基团；或其药学上可接受的盐和药学上可接受的载体、稀释剂或赋形剂。

  公开号：

  US05296499A1

文献信息

• Indole and Azaindole Derivatives with Antitumor Action
  申请人：Farina Carlo

  公开号：US20070248672A1

  公开（公告）日：2007-10-25

  Indole and azaindole compounds useful for the treatment of solid tumours and tumours of the blood are described, they being particularly effective in the treatment of drug resistant tumours; these compounds are also able to synergistically enhance the activity of known antitumour drugs. They can hence be used either alone as antitumour agents or in association with known antitumour drugs. Processes for preparing the aforesaid compounds, which are partly new, and pharmaceutical compositions useful for the aforesaid treatments are also described.

  本文描述了用于治疗实体肿瘤和血液肿瘤的吲哚和氮杂吲哚化合物，它们在治疗耐药性肿瘤方面特别有效；这些化合物还能够协同增强已知抗肿瘤药物的活性。因此，它们可以作为单独的抗肿瘤剂使用，也可以与已知的抗肿瘤药物联合使用。本文还描述了制备上述部分新化合物的过程以及用于上述治疗的制药组合物。
• INDOLE AND AZAINDOLE DERIVATIVES WITH ANTITUMOR ACTION
  申请人：NIKEM RESEARCH S.R.L.

  公开号：EP1750687A2

  公开（公告）日：2007-02-14
• INDOLE AND AZAINDOLE DERIVATIVES FOR THE TREATMENT OF INFLAMMATORY AND AUTOIMMUNE DISEASES
  申请人：BRANE DISCOVERY S.R.L.

  公开号：EP1945305A2

  公开（公告）日：2008-07-23
• US5296499A
  申请人：——

  公开号：US5296499A

  公开（公告）日：1994-03-22
• [EN] INDOLE AND AZAINDOLE DERIVATIVES WITH ANTITUMOR ACTION<br/>[FR] DERIVES D'INDOLE ET D'AZAINDOLE PRESENTANT UNE ACTIVITE ANTITUMORALE
  申请人：NIKEM RESEARCH SRL

  公开号：WO2005105213A2

  公开（公告）日：2005-11-10

  Indole and azaindole compounds useful for the treatment of solid tumours and tumours of the blood are described, they being particularly effective in the treatment of drug resistant tumours; these compounds are also able to synergistically enhance the activity of known antitumour drugs. They can hence be used either alone as antitumour agents or in association with known antitumour drugs. Processes for preparing the aforesaid compounds, which are partly new, and pharmaceutical compositions useful for the aforesaid treatments are also described.