{[3-(4-Methoxyphenyl)-1,2-oxazol-5-yl]methyl}(methyl)amine | 1040257-99-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: {[3-(4-Methoxyphenyl)-1,2-oxazol-5-yl]methyl}(methyl)amine
• 英文别名: 1-[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]-N-methylmethanamine
• CAS: 1040257-99-5
• 化学式: C₁₂H₁₄N₂O₂
• mdl: MFCD11215359
• 分子量: 218.255
• InChiKey: MVACDWSLSFIGER-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.4
• 重原子数：
  16
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  47.3
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  {[3-(4-Methoxyphenyl)-1,2-oxazol-5-yl]methyl}(methyl)amine 、 色酮-3-甲醛 在 三甲基氯硅烷 、 水 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 1.0h， 以70%的产率得到(2-hydroxyphenyl){5-[3-(4-methoxyphenyl)isoxazol-5-yl]-1-methyl-1H-pyrrol-3-yl}methanone
  参考文献：
  名称：

  A synthesis of 5-hetaryl-3-(2-hydroxybenzoyl)pyrroles

  摘要：

  A facile and versatile procedure for the synthesis of 5-hetaryl-3-(2-hydroxybenzoyl)-1H-pyrroles and 4-(2-hydroxybenzoyl)-1H-pyrrole-2-carboxylic acid derivatives was established on the basis of TMSCl promoted recyclization of 3-formylchromone with various hetarylmethylamines and glycine derivatives. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2008.04.041

文献信息

• Dpp-iv inhibitors
  申请人：Edwards John Paul

  公开号：US20070197522A1

  公开（公告）日：2007-08-23

  The invention relates to compounds of formula (I) Z-C(R 1 R 2 )—C(R 3 NH 2 )—C(R 4 R 5 )—X—N(R 6 R 7 )  (I), wherein Z, R 1-7 and X have the meaning as cited in the description and the claims. Said compounds are useful as DPP-IV inhibitors. The invention also relates to the preparation of such compounds as well as the production and use thereof as medicament.

  该发明涉及式（I）的化合物：Z-C（R1R2）-C（R3NH2）-C（R4R5）-X-N（R6R7）（I），其中Z，R1-7和X的含义如所述。所述化合物可用作DPP-IV抑制剂。该发明还涉及制备这种化合物以及其作为药物的生产和使用。
• A synthesis of 5-hetaryl-3-(2-hydroxybenzoyl)pyrroles
  作者：Andrey S. Plaskon、Sergey V. Ryabukhin、Dmitriy M. Volochnyuk、Alexander N. Shivanyuk、Andrey A. Tolmachev

  DOI：10.1016/j.tet.2008.04.041

  日期：2008.6

  A facile and versatile procedure for the synthesis of 5-hetaryl-3-(2-hydroxybenzoyl)-1H-pyrroles and 4-(2-hydroxybenzoyl)-1H-pyrrole-2-carboxylic acid derivatives was established on the basis of TMSCl promoted recyclization of 3-formylchromone with various hetarylmethylamines and glycine derivatives. (C) 2008 Elsevier Ltd. All rights reserved.