(3S,2'S)-3-[N-((2'-(1-Naphthyloxy)-4'-Carboxy)Butyryl)Leucinyl]Amino-4-Oxobutanoic Acid | 618880-73-2

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 肽模拟物
• 英文名称: (3S,2'S)-3-[N-((2'-(1-Naphthyloxy)-4'-Carboxy)Butyryl)Leucinyl]Amino-4-Oxobutanoic Acid
• 英文别名: 5-[[(2S)-1-[[(2S)-1-carboxy-3-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-naphthalen-1-yloxy-5-oxopentanoic acid
• CAS: 618880-73-2
• 化学式: C₂₅H₃₀N₂O₈
• 分子量: 486.522
• InChiKey: GQOWFRWKXDMQAF-PZFGBKGUSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  35
• 可旋转键数：
  14
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  159
• 氢给体数：
  4
• 氢受体数：
  8

反应信息

• 作为产物：
  描述：

  (3S,2'S)-3-[N-((2'-(1-naphthyloxy)-4'-carboxy)butyryl)leucinyl]amino-4-oxobutanoic acid semicarbazone 以 四氢呋喃 、 aqueous formaldehyde(1.0 ML)-acetic acid(1.0 ML)-methanol 为溶剂， 以85%的产率得到(3S,2'S)-3-[N-((2'-(1-Naphthyloxy)-4'-Carboxy)Butyryl)Leucinyl]Amino-4-Oxobutanoic Acid
  参考文献：
  名称：

  (Substituted)Acyl dipeptidyl inhibitors of the ice/ced-3 family of cysteine proteases

  摘要：

  这项发明涉及新型（取代）酰基二肽酶ICE/ced-3家族抑制剂化合物。该发明还涉及含有这些化合物的药物组合物，以及将这些组合物用于治疗患有炎症、自身免疫和神经退行性疾病的患者，预防缺血性损伤，以及保护即将进行移植手术的器官。

  公开号：

  US06242422B1

文献信息

• (Substituted)Acyl dipeptidyl inhibitors of the ICE/ced-3 family of cysteine proteases
  申请人：——

  公开号：US20040259804A1

  公开（公告）日：2004-12-23

  This invention is directed to novel (substituted) acyl dipeptidyl ICE/ced-3 family inhibitor compounds. The invention is also directed to pharmaceutical compositions containing these compounds, as well as the use of such compositions in the treatment of patients suffering inflammatory, autoimmune and neurodegenerative diseases, for the prevention of ischemic injury, and for the preservation of organs that are to undergo a transplantation procedure.

  本发明涉及新型（取代的）酰基二肽酰 ICE/ced-3 家族抑制剂化合物。本发明还涉及含有这些化合物的制药组合物，以及在治疗患有炎症、自身免疫和神经退行性疾病的患者、预防缺血性损伤以及保护即将进行移植手术的器官等方面使用这种组合物的用途。
• (Substituted)acyl dipeptidyl inhibitors of the ICE/ced-3 family of cysteine proteases
  申请人：——

  公开号：US20020091089A1

  公开（公告）日：2002-07-11

  This invention is directed to novel (substituted)acyl dipeptidyl ICE/ced-3 family inhibitor compounds. The invention is also directed to pharmaceutical compositions containing these compounds, as well as the use of such compositions in the treatment of patients suffering inflammatory, autoimmune and neurodegenerative diseases, for the prevention of ischemic injury, and for the preservation of organs that are to undergo a transplantation procedure.

  本发明涉及新型（取代）酰基二肽酶ICE/ced-3家族抑制剂化合物。本发明还涉及含有这些化合物的药物组合物，以及将这些组合物用于治疗患有炎症、自身免疫和神经退行性疾病的患者，预防缺血性损伤，以及保护即将进行移植手术的器官的用途。
• US6242422B1
  申请人：——

  公开号：US6242422B1

  公开（公告）日：2001-06-05
• US7157430B2
  申请人：——

  公开号：US7157430B2

  公开（公告）日：2007-01-02