2-(2,6-dibromophenyl)-3-(4,6-dimethylpyrimidin-2-yl)thiazolidin-4-one | 1104066-52-5

• 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-(2,6-dibromophenyl)-3-(4,6-dimethylpyrimidin-2-yl)thiazolidin-4-one
• 英文别名: 2-(2,6-dibromophenyl)-3-(4,6-dimethylpyrimidin-2-yl)-1,3-thiazolidin-4-one
• CAS: 1104066-52-5
• 化学式: C₁₅H₁₃Br₂N₃OS
• 分子量: 443.162
• InChiKey: HYNNFBLOABTILD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.2
• 重原子数：
  22
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.27
• 拓扑面积：
  71.4
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  2-氨基-4,6-二甲基嘧啶 、 2,6-二溴苯甲醛 、 巯基乙酸 以 甲苯 为溶剂， 反应 24.0h， 以42%的产率得到2-(2,6-dibromophenyl)-3-(4,6-dimethylpyrimidin-2-yl)thiazolidin-4-one
  参考文献：
  名称：

  Design and synthesis of 2-(2,6-dibromophenyl)-3-heteroaryl-1,3-thiazolidin-4-ones as anti-HIV agents

  摘要：

  A series of 2-(2,6-dibromophenyl)-3-heteroaryl-1,3-thiazolidin-4-ones were designed, synthesized and evaluated as selective human immunodeficiency virus type-1 reverse transcriptase (HIV-1 RT) enzyme inhibitors. The results of the HIV-1 RT kit and in vitro cell based assay showed that eight compounds effectively inhibited HIV-1 replication at 20-320 nM concentrations with minimal cytotoxicity in MT-4 as well as in CEM cells. (C) 2007 Elsevier Masson SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2007.12.015

文献信息

• Design and synthesis of 2-(2,6-dibromophenyl)-3-heteroaryl-1,3-thiazolidin-4-ones as anti-HIV agents
  作者：Ravindra K. Rawal、Rajkamal Tripathi、S.B. Katti、Christophe Pannecouque、Erik De Clercq

  DOI：10.1016/j.ejmech.2007.12.015

  日期：2008.12

  A series of 2-(2,6-dibromophenyl)-3-heteroaryl-1,3-thiazolidin-4-ones were designed, synthesized and evaluated as selective human immunodeficiency virus type-1 reverse transcriptase (HIV-1 RT) enzyme inhibitors. The results of the HIV-1 RT kit and in vitro cell based assay showed that eight compounds effectively inhibited HIV-1 replication at 20-320 nM concentrations with minimal cytotoxicity in MT-4 as well as in CEM cells. (C) 2007 Elsevier Masson SAS. All rights reserved.