Boc-Dmt-Tic-Ser-Bid | 1184170-71-5

• 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: Boc-Dmt-Tic-Ser-Bid
• CAS: 1184170-71-5
• 化学式: C₃₅H₄₁N₅O₆
• 分子量: 627.74
• InChiKey: LWWNEJPRTOZMBO-DTXPUJKBSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.12
• 重原子数：
  46.0
• 可旋转键数：
  8.0
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.37
• 拓扑面积：
  156.88
• 氢给体数：
  5.0
• 氢受体数：
  7.0

反应信息

• 作为反应物：
  描述：

  Boc-Dmt-Tic-Ser-Bid 在 三氟乙酸 作用下， 反应 0.5h， 以95%的产率得到
  参考文献：
  名称：

  Influence of the Side Chain Next to C-Terminal Benzimidazole in Opioid Pseudopeptides Containing the Dmt-Tic Pharmacophore

  摘要：

  To improve the structure-activity studies of the lead 6 opioid agonist H-Dmt-Tic-Asp*-Bid, we synthesized and pharmacologically characterized a series of analogues in which the side chain next to 1H-benzimidazole-2-yl (Bid) was substituted by those endowed with different chemical properties. Interesting results were obtained: (1) only Gly, Ala, and Asp resulted in delta agonism, (2) Phe yielded delta antagonism, (3) and all other residues except Glu (devoid of any activity) gave mu agonism.

  DOI：

  10.1021/jm900686q
• 作为产物：
  描述：

  Boc-Dmt-Tic-Ser(Ac)-Bid 在 sodium hydroxide 作用下， 以 甲醇 为溶剂， 以93%的产率得到Boc-Dmt-Tic-Ser-Bid
  参考文献：
  名称：

  Influence of the Side Chain Next to C-Terminal Benzimidazole in Opioid Pseudopeptides Containing the Dmt-Tic Pharmacophore

  摘要：

  To improve the structure-activity studies of the lead 6 opioid agonist H-Dmt-Tic-Asp*-Bid, we synthesized and pharmacologically characterized a series of analogues in which the side chain next to 1H-benzimidazole-2-yl (Bid) was substituted by those endowed with different chemical properties. Interesting results were obtained: (1) only Gly, Ala, and Asp resulted in delta agonism, (2) Phe yielded delta antagonism, (3) and all other residues except Glu (devoid of any activity) gave mu agonism.

  DOI：

  10.1021/jm900686q