4-(1-(4-fluorobenzyl)-1H-benzo[d]imidazol-2-yl)morpholine | 225117-60-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并咪唑类
• 英文名称: 4-(1-(4-fluorobenzyl)-1H-benzo[d]imidazol-2-yl)morpholine
• 英文别名: 1H-1,3-Benzimidazole, 1-[(4-fluorophenyl)methyl]-2-(4-morpholinyl)-；4-[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]morpholine
• CAS: 225117-60-2
• 化学式: C₁₈H₁₈FN₃O
• mdl: MFCD05859435
• 分子量: 311.359
• InChiKey: GWBATEXNUUJBGN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.2
• 重原子数：
  23
• 可旋转键数：
  3
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.28
• 拓扑面积：
  30.3
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  吗啉 、 1-(4-氟苄基)-2-氯苯并咪唑 在 三乙胺 作用下， 以 乙腈 为溶剂， 反应 72.0h， 以90%的产率得到4-(1-(4-fluorobenzyl)-1H-benzo[d]imidazol-2-yl)morpholine
  参考文献：
  名称：

  The high-pressure SNAr reaction of N-p-Fluorobenzyl-2-chlorobenzimidazole with amines; an approach to norastemizole and analogues

  摘要：

  N-p-fluorobenzyl-2-chlorobenzimidazole was treated under hyperbaric conditions with a variety of primary and secondary amines. The resulting SNAr reaction proceeded smoothly to produce excellent yields of adducts in most cases. This methodology provides rapid access to astemizole, norastemizole and related analogues. (C) 1999 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(99)00290-7

文献信息

• The high-pressure SNAr reaction of N-p-Fluorobenzyl-2-chlorobenzimidazole with amines; an approach to norastemizole and analogues
  作者：Ian C. Barrett、Michael A. Kerr

  DOI：10.1016/s0040-4039(99)00290-7

  日期：1999.3

  N-p-fluorobenzyl-2-chlorobenzimidazole was treated under hyperbaric conditions with a variety of primary and secondary amines. The resulting SNAr reaction proceeded smoothly to produce excellent yields of adducts in most cases. This methodology provides rapid access to astemizole, norastemizole and related analogues. (C) 1999 Elsevier Science Ltd. All rights reserved.