5-hydroxymethyl-1-phenethyl-1H-imidazole | 226930-22-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 5-hydroxymethyl-1-phenethyl-1H-imidazole
• 英文别名: [3-(2-Phenylethyl)imidazol-4-yl]methanol
• CAS: 226930-22-9
• 化学式: C₁₂H₁₄N₂O
• 分子量: 202.256
• InChiKey: ZXJMSYLCMJITTA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.1
• 重原子数：
  15
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  38
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  5-hydroxymethyl-1-phenethyl-1H-imidazole 在 三氧化硫吡啶 、 二甲基亚砜 、 三乙胺 作用下， 反应 3.0h， 生成 3-Phenethyl-3H-imidazole-4-carbaldehyde
  参考文献：
  名称：

  Parallel liquid synthesis of N,N′-Disubstituted 3-amino azepin-2-ones as potent and specific farnesyl transferase inhibitors

  摘要：

  A rapid structure-activity study was performed by parallel liquid synthesis on N,N'-disubstitution of 3-amino azepin-2-one to afford potent and specific farnesyl transferase inhibitors with low nM enzymatic and cellular activities. The activities of the selected compounds were validated in vivo, and compounds 41a and 44a presented significant antitumour activity. (C) 2003 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0968-0896(03)00218-9
• 作为产物：
  描述：

  在 双氧水 、 溶剂黄146 作用下， 反应 3.0h， 生成 5-hydroxymethyl-1-phenethyl-1H-imidazole
  参考文献：
  名称：

  Parallel liquid synthesis of N,N′-Disubstituted 3-amino azepin-2-ones as potent and specific farnesyl transferase inhibitors

  摘要：

  A rapid structure-activity study was performed by parallel liquid synthesis on N,N'-disubstitution of 3-amino azepin-2-one to afford potent and specific farnesyl transferase inhibitors with low nM enzymatic and cellular activities. The activities of the selected compounds were validated in vivo, and compounds 41a and 44a presented significant antitumour activity. (C) 2003 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0968-0896(03)00218-9

文献信息

• Imidazole derivatives having an inhibitory activity for farnesyl transferase and process for preparation thereof
  申请人：LG Chemical Ltd.

  公开号：US20020137769A1

  公开（公告）日：2002-09-26

  The present invention relates to novel imidazole derivatives which show an inhibitory activity against farnesyl transferase, pharmaceutically acceptable salts or isomers thereof and pharmaceutical compositions comprising such imidazole derivatives. More particularly, the present invention relates to intermediate compounds which are used in the preparation of the imidazole derivatives of the invention. Related processes also are disclosed.

  本发明涉及新型咪唑衍生物，其对法尼酰转移酶具有抑制活性，其药学上可接受的盐或异构体以及包含此类咪唑衍生物的制药组合物。更具体地说，本发明涉及用于制备本发明咪唑衍生物的中间化合物。相关的制备过程也被揭示。
• IMIDAZOLE DERIVATIVES HAVING AN INHIBITORY ACTIVITY FOR FARNESYL TRANSFERASE AND PROCESS FOR PREPARATION THEREOF
  申请人：LG CHEMICAL LIMITED

  公开号：EP1045846B1

  公开（公告）日：2003-05-02
• FARNESYL TRANSFERASE INHIBITORS HAVING A PYRROLE STRUCTURE AND PROCESS FOR PREPARATION THEREOF
  申请人：LG Chem Investment, Ltd.

  公开号：EP1169320B1

  公开（公告）日：2004-09-22
• US6268363B1
  申请人：——

  公开号：US6268363B1

  公开（公告）日：2001-07-31
• US6472526B1
  申请人：——

  公开号：US6472526B1

  公开（公告）日：2002-10-29