3-[(2-bromobenzyl)oxy]-5-(5,6-dimethoxy-1H-benzimidazol-1-yl)thiophene-2-carboxamide | 660868-93-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并咪唑类
• 英文名称: 3-[(2-bromobenzyl)oxy]-5-(5,6-dimethoxy-1H-benzimidazol-1-yl)thiophene-2-carboxamide
• 英文别名: 3-[(2-bromophenyl)methoxy]-5-(5,6-dimethoxy-1H-1,3-benzodiazol-1-yl)thiophene-2-carboxamide；3-[(2-bromophenyl)methoxy]-5-(5,6-dimethoxybenzimidazol-1-yl)thiophene-2-carboxamide
• CAS: 660868-93-9
• 化学式: C₂₁H₁₈BrN₃O₄S
• 分子量: 488.362
• InChiKey: TUIAPCRJMAZDMG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.4
• 重原子数：
  30
• 可旋转键数：
  7
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  117
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  methyl 3-[(2-bromobenzyl)oxy]-5-(5,6-dimethoxy-1H-benzimidazol-1-yl)thiophene-2-carboxylate 在 氨 作用下， 以 甲醇 为溶剂， 生成 3-[(2-bromobenzyl)oxy]-5-(5,6-dimethoxy-1H-benzimidazol-1-yl)thiophene-2-carboxamide
  参考文献：
  名称：

  Discovery of thiophene inhibitors of polo-like kinase

  摘要：

  The discovery and development of a series of thiophenes as potent and selective inhibitors of PLK is described. Identification and characterization of 2, a useful in vitro PLK inhibitor tool compound, is also presented. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2008.11.041

文献信息

• [EN] THIOPHENE COMPOUNDS<br/>[FR] COMPOSES DE BENZIMIDAZOLE-1-YL-THIOPHENE UTILISES EN CANCEROTHERAPIE
  申请人：SMITHKLINE BEECHAM CORP

  公开号：WO2004014899A1

  公开（公告）日：2004-02-19

  The present invention provides compounds of formula (I): (I) pharmaceutical compositions containing the same, processes for preparing the same and their use as pharmaceutical agents.

  本发明提供了式(I)的化合物： （I）含有相同化合物的药物组合物，制备该化合物的方法及其作为药物的应用。
• Thiophene compounds
  申请人：Andrews W Clarence

  公开号：US20060074119A1

  公开（公告）日：2006-04-06

  The present invention provides compounds of formula (1): pharmaceutical compositions containing the same, processes for preparing the same and their use as pharmaceutical agents.

  本发明提供了式（1）的化合物：含有相同化合物的药物组合物，制备该化合物的过程以及它们作为药物剂的用途。
• Benzimidazol-1-YL-thiophene compounds for the treatment of cancer
  申请人：Andrews Clarence W.

  公开号：US20080269298A1

  公开（公告）日：2008-10-30

  The present invention provides compounds of formula (I): pharmaceutical compositions containing the same, processes for preparing the same and their use as pharmaceutical agents.

  本发明提供了式(I)的化合物：含有它们的制药组合物，制备它们的方法以及它们作为药物的用途。
• BENZIMIDAZOL-1-YL-THIOPHENE COMPOUNDS FOR THE TREATMENT OF CANCER
  申请人：SmithKline Beecham Corporation

  公开号：EP1546137A1

  公开（公告）日：2005-06-29
• Process for preparing benzimidazole thiophenes
  申请人：Cheung Mui

  公开号：US20070060576A1

  公开（公告）日：2007-03-15

  The present invention provides a process for preparing benzimidazole thiophene compounds.