10-[(1-甲基-3-哌啶基)甲基]-10H-吡啶并[3,2-b][1,4]苯并噻嗪 | 67465-76-3

• 分子结构分类: 有机化合物 - 有机氮化合物
• 中文名称: 10-[(1-甲基-3-哌啶基)甲基]-10H-吡啶并[3,2-b][1,4]苯并噻嗪
• 英文名称: 10-((1-Methyl-3-piperidyl)methyl)-10H-pyrido(3,2-b)(1,4)benzothiazine
• 英文别名: 10-[(1-methylpiperidin-3-yl)methyl]pyrido[3,2-b][1,4]benzothiazine
• CAS: 67465-76-3
• 化学式: C₁₈H₂₁N₃S
• 分子量: 311.451
• InChiKey: RMNGITPGXJLUBV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.8
• 重原子数：
  22
• 可旋转键数：
  2
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.39
• 拓扑面积：
  44.7
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  2-苯胺基吡啶 在 碘 、 sulfur 、 lithium hexamethyldisilazane 作用下， 以 正己烷 、 水 、 甲苯 为溶剂， 反应 0.58h， 生成 10-[(1-甲基-3-哌啶基)甲基]-10H-吡啶并[3,2-b][1,4]苯并噻嗪
  参考文献：
  名称：

  Synthesis and antitubercular activity of phenothiazines with reduced binding to dopamine and serotonin receptors

  摘要：

  Analogs of the psychotropic phenothiazines were synthesized and examined as antitubercular agents against Mycobacterium tuberculosis H37Rv. The compounds were subsequently counter-screened for binding to the dopaminergic-receptor subtypes D1, D2, D3 and the serotonergic-receptor subtypes 5-HT1A, 5-HT2A, and 5-HT2C. The most active compounds showed MICs from 2 to 4 mu g/mL and had overall reduced binding to the dopamine and serotonin receptors compared to chlorpromazine and trifluoperazine. (C) 2007 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2007.03.064

文献信息

• Synthesis and antitubercular activity of phenothiazines with reduced binding to dopamine and serotonin receptors
  作者：Peter B. Madrid、Willma E. Polgar、Lawrence Toll、Mary J. Tanga

  DOI：10.1016/j.bmcl.2007.03.064

  日期：2007.6

  Analogs of the psychotropic phenothiazines were synthesized and examined as antitubercular agents against Mycobacterium tuberculosis H37Rv. The compounds were subsequently counter-screened for binding to the dopaminergic-receptor subtypes D1, D2, D3 and the serotonergic-receptor subtypes 5-HT1A, 5-HT2A, and 5-HT2C. The most active compounds showed MICs from 2 to 4 mu g/mL and had overall reduced binding to the dopamine and serotonin receptors compared to chlorpromazine and trifluoperazine. (C) 2007 Elsevier Ltd. All rights reserved.