1-(2-chlorophenyl)-2-methyl-5-phenyl-1H-pyrrole | 357989-03-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯
• 英文名称: 1-(2-chlorophenyl)-2-methyl-5-phenyl-1H-pyrrole
• 英文别名: 1-(2-Chlorophenyl)-2-methyl-5-phenylpyrrole
• CAS: 357989-03-8
• 化学式: C₁₇H₁₄ClN
• 分子量: 267.758
• InChiKey: VRUQYPOKKOFQGT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5
• 重原子数：
  19
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.06
• 拓扑面积：
  4.9
• 氢给体数：
  0
• 氢受体数：
  0

反应信息

• 作为反应物：
  描述：

  1-(2-chlorophenyl)-2-methyl-5-phenyl-1H-pyrrole 、 硫代吗啉 、 聚合甲醛 在 溶剂黄146 作用下， 以 水 、 乙腈 为溶剂， 反应 3.0h， 以45%的产率得到4-[[1-(2-Chlorophenyl)-2-methyl-5-phenyl-pyrrol-3-yl]methyl]thiomorpholine
  参考文献：
  名称：

  Antimycobacterial compounds. New pyrrole derivatives of BM212

  摘要：

  We have identified BM212 as a lead compound among a series of pyrrole derivatives with good in vitro activity against mycobacteria and candidae. First studies led us to synthesize some pyrrole compounds in which the thiomorpholine fragment was present. Some compounds revealed very active and these findings prompted us to prepare new pyrrole derivatives 2-15 in the hope of increasing the activity. The microbiological data showed interesting in vitro activity against Mycobacterium tuberculosis and atypical mycobacteria. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2003.12.037
• 作为产物：
  描述：

  苯乙烯 在 叔丁基过氧化氢 、 manganese(II) chloride tetrahydrate 、 氨基磺酸 、 copper(II) bis(trifluoromethanesulfonate) 、 1,8-二氮杂双环[5.4.0]十一碳-7-烯 作用下， 以 水 为溶剂， 反应 25.0h， 生成 1-(2-chlorophenyl)-2-methyl-5-phenyl-1H-pyrrole
  参考文献：
  名称：

  使用TBHP，三氟甲磺酸铜（II）和氨基磺酸从苯乙烯，丙酮和芳基胺一锅合成2-甲基-1,5-二芳基-1 H-吡咯

  摘要：

  研究了芳胺衍生物与苯乙烯和丙酮的一锅铜/锰共催化杂环化反应，生成一系列2-甲基-1,5-二氮杂-1 H-吡咯。所述反应结合了1，4-二羰基合成和Paal-Knorr型缩合反应。

  DOI：

  10.1016/j.tetlet.2017.12.031

文献信息

• Antimycobacterial compounds. New pyrrole derivatives of BM212
  作者：Mariangela Biava、Giulio Cesare Porretta、Delia Deidda、Raffaello Pompei、Andrea Tafi、Fabrizio Manetti

  DOI：10.1016/j.bmc.2003.12.037

  日期：2004.3

  We have identified BM212 as a lead compound among a series of pyrrole derivatives with good in vitro activity against mycobacteria and candidae. First studies led us to synthesize some pyrrole compounds in which the thiomorpholine fragment was present. Some compounds revealed very active and these findings prompted us to prepare new pyrrole derivatives 2-15 in the hope of increasing the activity. The microbiological data showed interesting in vitro activity against Mycobacterium tuberculosis and atypical mycobacteria. (C) 2004 Elsevier Ltd. All rights reserved.
• One-pot synthesis of 2-methyl-1,5-diaromatic-1H-pyrroles from styrene, acetone and arylamines using TBHP, copper(II) trifluoromethanesulfonate and sulfamic acid
  作者：Congjun Xu、Yufei Han、Shaowei Chen、Dengzhi Xu、Bingfu Zhang、Zhenliang Shan、Shimei Du、Liying Xu、Ping Gong

  DOI：10.1016/j.tetlet.2017.12.031

  日期：2018.1

  co-catalyzed heterocyclization of arylamine derivatives with styrene and acetone to produce a series of 2-methyl-1,5-diaromatic-1H-pyrroles was investigated. The described reaction combines 1,4-dicarbonyl synthesis and Paal-Knorr type condensation reactions.

  研究了芳胺衍生物与苯乙烯和丙酮的一锅铜/锰共催化杂环化反应，生成一系列2-甲基-1,5-二氮杂-1 H-吡咯。所述反应结合了1，4-二羰基合成和Paal-Knorr型缩合反应。