2-O-tert-butyl 4-O-methyl 3-ethyl-5-[[2-(1H-1,2,4-triazol-5-yl)ethylamino]methyl]-1H-pyrrole-2,4-dicarboxylate

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯
• 英文名称: 2-O-tert-butyl 4-O-methyl 3-ethyl-5-[[2-(1H-1,2,4-triazol-5-yl)ethylamino]methyl]-1H-pyrrole-2,4-dicarboxylate
• 化学式: C₁₈H₂₇N₅O₄
• 分子量: 377.4
• InChiKey: HRHNUDHZLMFTFS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2
• 重原子数：
  27
• 可旋转键数：
  11
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  122
• 氢给体数：
  3
• 氢受体数：
  7

文献信息

• [EN] TYROSINE KINASE INHIBITORS<br/>[FR] INHIBITEURS DE TYROSINE KINASE
  申请人：MERCK & CO INC

  公开号：WO2003035615A2

  公开（公告）日：2003-05-01

  The present invention relates to compounds that are capable of inhibiting, modulating and/or regulating signal transduction of both receptor-type and non-receptor type tyrosine kinases. The compounds of the instant invention possess a core structure that comprises a 2-carboxy pyrrole. The present invention is also related to the pharmaceutically acceptable salts, hydrates and stereoisomers of these compounds.