(2S)-(4-tert-Butoxycarbonylmethyl-benzylamino)-succinic Acid Diallyl Ester | 447405-80-3

• 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: (2S)-(4-tert-Butoxycarbonylmethyl-benzylamino)-succinic Acid Diallyl Ester
• 英文别名: bis(prop-2-enyl) (2S)-2-[[4-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]phenyl]methylamino]butanedioate
• CAS: 447405-80-3
• 化学式: C₂₃H₃₁NO₆
• 分子量: 417.502
• InChiKey: WKNPXGJEPCOUEC-IBGZPJMESA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.1
• 重原子数：
  30
• 可旋转键数：
  16
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.43
• 拓扑面积：
  90.9
• 氢给体数：
  1
• 氢受体数：
  7

文献信息

• Pharmaceutical uses and synthesis of diketopiperazines
  申请人：Celltech R & D, Inc.

  公开号：US20020187984A1

  公开（公告）日：2002-12-12

  The synthesis of novel diketopiperazines, their use in inhibiting cellular events such as those involving NFK-&agr;, NFK-&bgr; and in the treatment of inflammation events, a combinatorial library of diverse diketopiperazines and process for their synthesis as a library and as individual compounds. In particular novel diketopiperazines are disclosed including their synthesis and use in cellular events such as activation of the transcription factor, nuclear factor, TNF-&agr;, TNF-&bgr; and also apoptosis.

  合成新型二酮肽、它们在抑制细胞事件中的应用，如涉及NFK-α、NFK-β和治疗炎症事件，多样化二酮肽组合库及其作为库和单个化合物的合成过程。特别是披露了新型二酮肽，包括它们的合成和在细胞事件中的应用，如转录因子、核因子、TNF-α、TNF-β的激活以及凋亡。
• US6815214B2
  申请人：——

  公开号：US6815214B2

  公开（公告）日：2004-11-09
• [EN] PHARMACEUTICAL USES AND SYNTHESIS OF DIKETOPIPERAZINES<br/>[FR] UTILISATIONS PHARMACEUTIQUES ET SYNTHESE DE DICETOPIPERAZINES
  申请人：CELLTECH R & D INC

  公开号：WO2002062797A2

  公开（公告）日：2002-08-15

  The synthesis of novel diketopiperazines, their use in inhibiting cellular events such as those involving NFK-α, NFK-β and in the treatment of inflammation events, a combinatorial library of diverse diketopiperazines and process for their synthesis as a library and as individual compounds. In particular novel diketopiperazines are disclosed including their synthesis and use in cellular events such as activation of the transcription factor, nuclear factor, TNF-α, TNF-β and also apoptosis.