Tert-butyl 3-(2-bromo-5-methylphenyl)-2-methylpropanoate

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: Tert-butyl 3-(2-bromo-5-methylphenyl)-2-methylpropanoate
• 英文别名: tert-butyl 3-(2-bromo-5-methylphenyl)-2-methylpropanoate
• 化学式: C₁₅H₂₁BrO₂
• 分子量: 313.23
• InChiKey: DNRHUGMBVFDOCK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.6
• 重原子数：
  18
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.53
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

文献信息

• TYROSINE DERIVATIVE AND METHOD FOR PRODUCING TYROSINE DERIVATIVE
  申请人：NARD Institute, Ltd.

  公开号：US20140187814A1

  公开（公告）日：2014-07-03

  The objective of the present invention is to provide a tyrosine derivative which is useful as a melatonin MT 1 receptor antagonist, and a method for producing a specific tyrosine derivative with high yield by efficiently introducing an iodine atom at the para position of the phenolic hydroxy group in the benzene ring of tyrosine with good regioselectivity. The tyrosine derivative of the present invention is characterized in being represented by the following formula (I): wherein R 1 is a protective group of the amino group and the like; R 2 is a protective group of the carboxy group and the like; R 3 is a hydrogen atom and the like; R 4 is a halogen atom and the like; A is —(CH 2 ) l —[Z(CH 2 ) m ] n —; X is a leaving group.

  本发明的目的是提供一种对苯酪氨酸衍生物，该衍生物可用作褪黑激素MT1受体拮抗剂，并通过在对苯酚羟基的苯环中有效地引入碘原子，以高产率生产具有良好区域选择性的特定对苯酪氨酸衍生物的方法。本发明的对苯酪氨酸衍生物的特征在于其由以下公式（I）表示：其中R1是氨基的保护基等；R2是羧基的保护基等；R3是氢原子等；R4是卤原子等；A是—(CH2)l—[Z( )m]n—；X是离去基团。
• US8907126B2
  申请人：——

  公开号：US8907126B2

  公开（公告）日：2014-12-09