(2,4-Dichlorophenyl)-[1-(2,4-dimethylphenyl)sulfonylpyrrol-3-yl]methanol

• 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: (2,4-Dichlorophenyl)-[1-(2,4-dimethylphenyl)sulfonylpyrrol-3-yl]methanol
• 化学式: C₁₉H₁₇Cl₂NO₃S
• 分子量: 410.321
• InChiKey: POPJAULQELMUPW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.7
• 重原子数：
  26
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.16
• 拓扑面积：
  67.7
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  1-[(2,4-dimethylphenyl)sulfonyl]-1H-pyrrole 在 sodium tetrahydroborate 、 三氯化铝 作用下， 以 四氢呋喃 为溶剂， 生成 (2,4-Dichlorophenyl)-[1-(2,4-dimethylphenyl)sulfonylpyrrol-3-yl]methanol
  参考文献：
  名称：

  1-Arylsulfonyl-3-(α-hydroxybenzyl)-1H-pyrroles, a novel class of anti-HIV-1 reverse transcriptase inhibitors

  摘要：

  Various 1-arylsulfonyl-3-(alpha-hydroxybenzyl)-1H-pyrroles were prepared by Friedel-Crafts reaction of 1-aryisulfonyl-1H-pyrroles with aroylchlorides in the presence of aluminum trichloride, followed by reduction of the ketones to the required carbinols. Title compounds were identified as a novel class of nonnucleoside HIV-1 reverse transcriptase inhibitors characterized by the presence of a diarylcarbinol moiety, a chemical feature that strictly correlates with the anti-HTV-1 activity. (C) 1997 Elsevier Science Ltd.

  DOI：

  10.1016/s0960-894x(97)00340-5

文献信息

• 1-Arylsulfonyl-3-(α-hydroxybenzyl)-1H-pyrroles, a novel class of anti-HIV-1 reverse transcriptase inhibitors
  作者：Marino Artico、Roberto Di Santo、Roberta Costi、Silvio Massa、Franca Scintu、Anna Giulia Loi、Antonella De Montis、Paolo La Colla

  DOI：10.1016/s0960-894x(97)00340-5

  日期：1997.7

  Various 1-arylsulfonyl-3-(alpha-hydroxybenzyl)-1H-pyrroles were prepared by Friedel-Crafts reaction of 1-aryisulfonyl-1H-pyrroles with aroylchlorides in the presence of aluminum trichloride, followed by reduction of the ketones to the required carbinols. Title compounds were identified as a novel class of nonnucleoside HIV-1 reverse transcriptase inhibitors characterized by the presence of a diarylcarbinol moiety, a chemical feature that strictly correlates with the anti-HTV-1 activity. (C) 1997 Elsevier Science Ltd.