4-[5-(2-N,N-dimethylaminoethyl)-2-methyl-imidazol-1-ylmethyl]-2-[3-(3S-ethyl-1-methyl-2-oxo-azepan-3-yl)-phenoxy]-benzonitrile | 275806-62-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 异喹啉及其衍生物
• 英文名称: 4-[5-(2-N,N-dimethylaminoethyl)-2-methyl-imidazol-1-ylmethyl]-2-[3-(3S-ethyl-1-methyl-2-oxo-azepan-3-yl)-phenoxy]-benzonitrile
• 英文别名: 4-[[5-[2-(dimethylamino)ethyl]-2-methylimidazol-1-yl]methyl]-2-[3-[(3S)-3-ethyl-1-methyl-2-oxoazepan-3-yl]phenoxy]benzonitrile
• CAS: 275806-62-7
• 化学式: C₃₁H₃₉N₅O₂
• 分子量: 513.683
• InChiKey: AUFILOVTNXOKBW-HKBQPEDESA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.6
• 重原子数：
  38
• 可旋转键数：
  9
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  74.4
• 氢给体数：
  0
• 氢受体数：
  5

文献信息

• Inhibitors of prenyl-protein transferase
  申请人：Merck & Co., Inc.

  公开号：US20020037888A1

  公开（公告）日：2002-03-28

  The present invention is directed to compounds which inhibit prenyl-protein transferase (FTase) and the prenylation of the oncogene protein Ras. The invention is further directed to chemotherapeutic compositions containing the compounds of this invention and methods for inhibiting prenyl-protein transferase and the prenylation of the oncogene protein Ras.

  本发明涉及抑制前醇基-蛋白质转移酶（FTase）和致癌基因蛋白Ras的前醇化的化合物。该发明进一步涉及含有本发明化合物的化疗组合物以及抑制前醇基-蛋白质转移酶和致癌基因蛋白Ras的方法。
• US6284755B1
  申请人：——

  公开号：US6284755B1

  公开（公告）日：2001-09-04
• [EN] INHIBITORS OF PRENYL-PROTEIN TRANSFERASE<br/>[FR] INHIBITEURS DE PRENYL-PROTEINE TRANSFERASE
  申请人：MERCK & CO INC

  公开号：WO2000034437A2

  公开（公告）日：2000-06-15

  The present invention is directed to compounds which inhibit prenyl-protein transferase (FTase) and the prenylation of the oncogene protein Ras. The invention is further directed to chemotherapeutic compositions containing the compounds of this invention and methods for inhibiting prenyl-protein transferase and the prenylation of the oncogene protein Ras.