2-iodo-5-methoxybenzenepropanoyl chloride | 99254-55-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: 2-iodo-5-methoxybenzenepropanoyl chloride
• 英文别名: 3-(2-Iodo-5-methoxyphenyl)propanoyl chloride
• CAS: 99254-55-4
• 化学式: C₁₀H₁₀ClIO₂
• 分子量: 324.546
• InChiKey: GGJOAFLUQJVILL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.3
• 重原子数：
  14
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2-iodo-5-methoxybenzenepropanoyl chloride 在 吡啶 、 硼烷 作用下， 以 四氢呋喃 、 N,N-二甲基甲酰胺 为溶剂， 反应 23.0h， 生成 3-[5-Methoxy-2-(phenylethynyl)phenyl]-N,N-dimethylpropanamine
  参考文献：
  名称：

  2-Ethynylbenzenealkanamines. A new class of calcium entry blockers

  摘要：

  A series of 2-(aryl- or alkylethynyl)benzenealkanamines were synthesized. They exhibit antihypertensive activity in spontaneously hypertensive rats and coronary vasodilator activity with minimal negative inotropic activity in the "Langendorff" guinea pig heart in vitro. They have been shown to exert their activity by inhibition of Ca2+ influx across cell membranes. Optimal activity is found among the N-(arylethyl)-5-methoxy-alpha-methyl-2-(phenylethynyl)ben zeneethanamines and -propanamines.

  DOI：

  10.1021/jm00398a023
• 作为产物：
  描述：

  3-(2-iodo-5-methoxyphenyl)propanoic acid 在 草酰氯 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 16.0h， 生成 2-iodo-5-methoxybenzenepropanoyl chloride
  参考文献：
  名称：

  2-Ethynylbenzenealkanamines. A new class of calcium entry blockers

  摘要：

  A series of 2-(aryl- or alkylethynyl)benzenealkanamines were synthesized. They exhibit antihypertensive activity in spontaneously hypertensive rats and coronary vasodilator activity with minimal negative inotropic activity in the "Langendorff" guinea pig heart in vitro. They have been shown to exert their activity by inhibition of Ca2+ influx across cell membranes. Optimal activity is found among the N-(arylethyl)-5-methoxy-alpha-methyl-2-(phenylethynyl)ben zeneethanamines and -propanamines.

  DOI：

  10.1021/jm00398a023

文献信息

• Aralykyl (arylethynyl)aralkyl amines and their use as vasodilators and
  申请人：McNeilab, Inc.

  公开号：US04661635A1

  公开（公告）日：1987-04-28

  Acetylenes of the formula (I): ##STR1## wherein Y, m, R.sup.1, R.sup.2 q, Alk, R.sup.3, n and R.sup.4 are as defined herein and Ar.sup.1 and Ar.sup.2 are aromatic, including the salts and ammonium derivatives of formula (I), in treating angina, hypertension and cardiac arrhythmias. Pharmaceutical compositions, methods of use and synthesis and novel intermediates are also part of the invention.

  公式（I）的乙炔化合物：##STR1## 其中Y，m，R.sup.1，R.sup.2，q，Alk，R.sup.3，n和R.sup.4如本文所定义，Ar.sup.1和Ar.sup.2是芳香族，包括公式（I）的盐和铵衍生物，在治疗心绞痛、高血压和心律不齐方面具有作用。药物组合物、使用方法、合成方法和新颖中间体也是该发明的一部分。
• Acetylene amines and their use as vasodilators and antihypertensives
  申请人：McNeilab, Inc.

  公开号：US04725602A1

  公开（公告）日：1988-02-16

  Acetylenes of the following formula (I): ##STR1## wherein Y, m, R.sup.1, R.sup.2, R.sup.3, n and R.sup.4 are defined herein and R.sup.5 is hydrogen, alkyl, cycloalkyl or substituted alkyl are useful vasodilators and antihypertensives.

  以下式(I)的乙炔化合物：##STR1## 其中Y、m、R.sup.1、R.sup.2、R.sup.3、n和R.sup.4的定义见下文，R.sup.5是氢、烷基、环烷基或取代烷基，是有用的血管扩张剂和降压药物。
• Acetylene derivatives for the treatment of hypertension and angina
  申请人：McNeilab, Inc.

  公开号：EP0145361A2

  公开（公告）日：1985-06-19

  57 Acetylene compounds of the formula (I): wherein Y, R1, R,, R3, and R4 are as described herein, m is 0-3, n is 0-2 and Ar is pehnyl or an aromatic heterocycle are disclosed. The compounds possess antihypertensive and anti-anginal properties and may be used in the treatment of humans. Methods for the preparation and use of such acetylene compounds are also disclosed.

  57 本发明公开了式 (I) 的乙炔化合物：其中 Y、R1、R、R3 和 R4 如本文所述，m 为 0-3，n 为 0-2，Ar 为正烷基或芳香杂环。 这些化合物具有抗高血压和抗心绞痛的特性，可用于人类治疗。 本发明还公开了制备和使用此类乙炔化合物的方法。
• Aralykyl (arylethynyl) aralkyl amines for use as vasodilators and antihypertensives
  申请人：McNeilab, Inc.

  公开号：EP0146271A2

  公开（公告）日：1985-06-26

  Acetylenes of the formula (I): wherein Y, m, R1, R2, q, Alk, R3, n and R4 are as defined herein and Ar1 and Ar2 are aromatic, including the salts and ammonium derivatives of formula (I), in treating angina, hypertension and cardiac arrhythmias. Pharmaceutical compositions, methods of use and synthesis and novel intermediates are also part of the invention.

  式（I）：其中 Y、m、R1、R2、q、Alk、R3、n 和 R4 如本文所定义，Ar1 和 Ar2 为芳香族的乙炔，包括式（I）的盐和铵衍生物，用于治疗心绞痛、高血压和心律失常。 药物组合物、使用和合成方法以及新型中间体也是本发明的一部分。
• Cis & trans stilbenes and their composition for the treatment of hypertension
  申请人：McNeilab, Inc.

  公开号：EP0250254B1

  公开（公告）日：1991-06-19