{4-[2-Acetylamino-2-(3-carbamoyl-2-cyclohexylmethoxy-6,7,8,9-tetrahydro-5H-benzocyclohepten-5ylcarbamoyl)-ethyl]-2-phosphono-phenyl}-phosphonic acid | 268741-43-1

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: {4-[2-Acetylamino-2-(3-carbamoyl-2-cyclohexylmethoxy-6,7,8,9-tetrahydro-5H-benzocyclohepten-5ylcarbamoyl)-ethyl]-2-phosphono-phenyl}-phosphonic acid
• 英文别名: [4-[(2S)-2-acetamido-3-[[(5S)-3-carbamoyl-2-(cyclohexylmethoxy)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-yl]amino]-3-oxopropyl]-2-phosphonophenyl]phosphonic acid
• CAS: 268741-43-1
• 化学式: C₃₀H₄₁N₃O₁₀P₂
• 分子量: 665.6
• InChiKey: SPSGYTWOIGAABK-DQEYMECFSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1
• 重原子数：
  45
• 可旋转键数：
  11
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  226
• 氢给体数：
  7
• 氢受体数：
  10

文献信息

• Bicyclic signal transduction inhibitors, compositions containing them & uses thereof
  申请人：——

  公开号：US20020062031A1

  公开（公告）日：2002-05-23

  This invention concerns compounds for inhibiting intracellular signal transduction, especially intracellular signal transduction mediated by one or more molecular interactions involving a phosphotyrosine-containing protein. This invention also relates to pharmaceutical compositions containing the compounds and prophylactic and therapeutic methods involving pharmaceutical and veterinary administration of the compounds. The compounds are of the formula 1 as defined herein.

  本发明涉及用于抑制细胞内信号转导的化合物，特别是介导涉及含有磷酸酪氨酸蛋白质的一个或多个分子相互作用的细胞内信号转导。本发明还涉及含有这些化合物的药物组合物以及涉及药物和兽医管理这些化合物的预防和治疗方法。这些化合物的公式1如本文所定义。
• BICYCLIC SIGNAL TRANSDUCTION INHIBITORS, COMPOSITIONS CONTAINING THEM & USES THEREOF
  申请人：——

  公开号：US20020137941A1

  公开（公告）日：2002-09-26

  This invention concerns compounds for inhibiting intracellular signal transduction, especially intracellular signal transduction mediated by one or more molecular interactions involving a phosphotyrosine-containing protein. This invention also relates to pharmaceutical compositions containing the compounds and prophylactic and therapeutic methods involving pharmaceutical and veterinary administration of the compounds. The compounds are of the formula 1 as defined herein.

  本发明涉及用于抑制细胞内信号转导的化合物，特别是介导涉及磷酸酪氨酸含有蛋白质的一个或多个分子相互作用的细胞内信号转导。本发明还涉及含有该化合物的药物组合物以及使用该化合物进行药物和兽医治疗的预防和治疗方法。该化合物的公式1如定义所述。
• US6482852B2
  申请人：——

  公开号：US6482852B2

  公开（公告）日：2002-11-19
• US6573295B2
  申请人：——

  公开号：US6573295B2

  公开（公告）日：2003-06-03