2-fluoro-4-hydroxybenzothioamide | 1174738-05-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 酚类
• 英文名称: 2-fluoro-4-hydroxybenzothioamide
• 英文别名: 2-fluoro-4-hydroxybenzenecarbothioamide；2-Fluoro-4-hydroxybenzene-1-carbothioamide
• CAS: 1174738-05-6
• 化学式: C₇H₆FNOS
• 分子量: 171.195
• InChiKey: ICCQTOGHNGSILO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.1
• 重原子数：
  11
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  78.3
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  3-溴-4-哌啶酮氢溴酸盐 、 2-fluoro-4-hydroxybenzothioamide 在 氩 、 3-fluoro-4-(4,5,6,7-tetrahydro[1,3]thiazolo[5,4-c]pyridin-2-yl)phenol 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 16.0h， 生成 3-fluoro-4-(4,5,6,7-tetrahydro[1,3]thiazolo[5,4-c]pyridin-2-yl)phenol
  参考文献：
  名称：

  Compounds Comprising A Cyclobutoxy Group

  摘要：

  本发明涉及包含环丁氧基的化合物(I)的公式，其制备过程，包含所述化合物的药物组合物以及它们作为药物的用途。

  公开号：

  US20100292188A1
• 作为产物：
  描述：

  2-氟-4-羟基苯腈 在 phosphorus pentasulfide 作用下， 以 乙醇 为溶剂， 以100%的产率得到2-fluoro-4-hydroxybenzothioamide
  参考文献：
  名称：

  [EN] COMPOUNDS COMPRISING A CYCLOBUTOXY GROUP
  [FR] COMPOSÉS COMPRENANT UN GROUPE CYCLOBUTOXY

  摘要：

  本发明涉及具有环丁氧基的化合物(I)的公式，制备它们的方法，包含所述化合物的药物组合物以及它们作为药物的用途。

  公开号：

  WO2009092764A1

文献信息

• [EN] COMPOUNDS COMPRISING A CYCLOBUTOXY GROUP<br/>[FR] COMPOSÉS COMPRENANT UN GROUPE CYCLOBUTOXY
  申请人：UCB PHARMA SA

  公开号：WO2009092764A1

  公开（公告）日：2009-07-30

  The present invention relates to compounds of formula (I) comprising a cyclobutoxy group, processes for preparing them, pharmaceutical compositions comprising said compounds and their use as pharmaceuticals.

  本发明涉及具有环丁氧基的化合物(I)的公式，制备它们的方法，包含所述化合物的药物组合物以及它们作为药物的用途。
• COMPOUNDS COMPRISING A CYCLOBUTOXY GROUP
  申请人：UCB Pharma, S.A.

  公开号：EP2238144A1

  公开（公告）日：2010-10-13
• Arylthioamides as H₂S Donors: <scp>l</scp>-Cysteine-Activated Releasing Properties and Vascular Effects in Vitro and in Vivo
  作者：Alma Martelli、Lara Testai、Valentina Citi、Alice Marino、Isabella Pugliesi、Elisabetta Barresi、Giulia Nesi、Simona Rapposelli、Sabrina Taliani、Federico Da Settimo、Maria C. Breschi、Vincenzo Calderone

  DOI：10.1021/ml400239a

  日期：2013.10.10

  A small library of arylthioamides 1-12 was easily synthesized, and their H2S-releasing properties were evaluated both in the absence or in the presence of an organic thiol such as L-cysteine. A number of arylthioamides (1-3 and 7) showed a slow and L-cysteine-dependent H2S-releasing mechanism, similar to that exhibited by the reference slow H2S-releasing agents, such as diallyl disulfide (DADS) and the phosphinodithioate derivative GYY 4137. Compound 1 strongly abolished the noradrenaline-induced vasoconstriction in isolated rat aortic rings and hyperpolarized the membranes of human vascular smooth muscle cells in a concentration-dependent fashion. Finally, a significant reduction of the systolic blood pressure of anesthetized normotensive rats was observed after its oral administration. Altogether these results highlighted the potential of arylthioamides 1-3 and 7 as H2S-donors for basic studies, and for the rational design/development of promising pharmacotherapeutic agents to treat cardiovascular diseases.
• Compounds Comprising A Cyclobutoxy Group
  申请人：Denonne Frédéric

  公开号：US20100292188A1

  公开（公告）日：2010-11-18

  The present invention relates to compounds of formula (I) comprising a cyclobutoxy group, processes for preparing them, pharmaceutical compositions comprising said compounds and their use as pharmaceuticals.

  本发明涉及包含环丁氧基的化合物(I)的公式，其制备过程，包含所述化合物的药物组合物以及它们作为药物的用途。