| 287208-90-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• CAS: 287208-90-6
• 化学式: C₃₅H₃₉NO₃
• 分子量: 521.7
• InChiKey: ARKUZKGMJLUUNY-HHHXNRCGSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.33
• 重原子数：
  39.0
• 可旋转键数：
  10.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.29
• 拓扑面积：
  38.77
• 氢给体数：
  0.0
• 氢受体数：
  3.0

反应信息

• 作为反应物：
  描述：

  在 10% palladium on carbon 、 氢气 作用下， 生成 4-[(2R)-2-aminopropyl]-2-tert-butylphenol
  参考文献：
  名称：

  Discovery of novel motilin antagonists: Conversion of tetrapeptide leads to orally available peptidomimetics

  摘要：

  We successfully discovered peptidomimetic motilin antagonists (17c and 17d) through the improvement of physicochemical properties of a tetrapeptide antagonist (2). Furthermore, with oral administration and based on motilin antagonistic activity, both compounds suppressed motilin-induced colonic and gastric motility in conscious dogs. (C) 2009 Published by Elsevier Ltd.

  DOI：

  10.1016/j.bmcl.2009.05.059
• 作为产物：
  描述：

  在 lithium triethylborohydride 作用下， 生成
  参考文献：
  名称：

  Discovery of novel motilin antagonists: Conversion of tetrapeptide leads to orally available peptidomimetics

  摘要：

  We successfully discovered peptidomimetic motilin antagonists (17c and 17d) through the improvement of physicochemical properties of a tetrapeptide antagonist (2). Furthermore, with oral administration and based on motilin antagonistic activity, both compounds suppressed motilin-induced colonic and gastric motility in conscious dogs. (C) 2009 Published by Elsevier Ltd.

  DOI：

  10.1016/j.bmcl.2009.05.059