4,5-二溴噻吩-3-甲醛 | 61200-56-4

• 分子结构分类: 有机化合物 - 有机氧化合物
• 中文名称: 4,5-二溴噻吩-3-甲醛
• 英文名称: 4,5-dibromothiophene-3-carbaldehyde
• CAS: 61200-56-4
• 化学式: C₅H₂Br₂OS
• 分子量: 269.944
• InChiKey: URRXBIOGMCUMSR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  9
• 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：
  45.3
• 氢给体数：
  0
• 氢受体数：
  2

安全信息

• 海关编码：
  2934999090

反应信息

• 作为反应物：
  描述：

  4,5-二溴噻吩-3-甲醛 在 sodium hydroxide 、 potassium permanganate 作用下， 生成 4,5-二溴-噻吩-3-羧酸
  参考文献：
  名称：

  Novel thienopyrrole glycogen phosphorylase inhibitors: Synthesis, in vitro SAR and crystallographic studies

  摘要：

  Two series of novel thienopyrrole inhibitors of recombinant human liver glycogen phosphorylase a (GPa) which are effective in reducing glucose output from rat hepatocytes are described. Representative compounds have been shown to bind at the dimer interface site of the rabbit muscle enzyme by X-ray crystallography.

  DOI：

  10.1016/j.bmcl.2006.08.047
• 作为产物：
  描述：

  3-噻吩甲醛 生成 4,5-二溴噻吩-3-甲醛
  参考文献：
  名称：

  GRONOWITZ S.; ANDER I., TETRAHEDRON , 1976, 32, NO 12, 1403-1406

  摘要：

  DOI：

文献信息

• [EN] SUBSTITUTED THIOPENES OR FURANS AS ESTROGEN RECEPTOR LIGANDS<br/>[FR] THIOPHÈNES OU FURANNES SUBSTITUÉS COMME LIGANDS DE RÉCEPTEURS DES OESTROGÈNES
  申请人：KAROBIO AB

  公开号：WO2012022776A1

  公开（公告）日：2012-02-23

  The invention provides: a compound of Formula (I) or a pharmaceutically acceptable ester, amide, or salt thereof, including a salt of such an ester or amide, wherein A, B, R1, R2, R4, R5, R6 and R7 are as defined in the specification. The indention also provides the use of such compounds in the treatment or prophylaxis of a condition associated with a disease or disorder associated with estrogen receptor activity.

  该发明提供：式（I）的化合物或其药用可接受的酯、酰胺或盐，包括该酯或酰胺的盐，其中A、B、R1、R2、R4、R5、R6和R7如规范中所定义。该发明还提供了利用这些化合物治疗或预防与雌激素受体活性相关的疾病或紊乱的用途。
• Novel thienopyrrole glycogen phosphorylase inhibitors: Synthesis, in vitro SAR and crystallographic studies
  作者：Paul R.O. Whittamore、Matthew S. Addie、Stuart N.L. Bennett、Alan M. Birch、Michael Butters、Linda Godfrey、Peter W. Kenny、Andrew D. Morley、Paul M. Murray、Nikos G. Oikonomakos、Ludovic R. Otterbein、Andrew D. Pannifer、Jeremy S. Parker、Kristy Readman、Pawel S. Siedlecki、Paul Schofield、Andy Stocker、Melvyn J. Taylor、Linda A. Townsend、David P. Whalley、Jennifer Whitehouse

  DOI：10.1016/j.bmcl.2006.08.047

  日期：2006.11

  Two series of novel thienopyrrole inhibitors of recombinant human liver glycogen phosphorylase a (GPa) which are effective in reducing glucose output from rat hepatocytes are described. Representative compounds have been shown to bind at the dimer interface site of the rabbit muscle enzyme by X-ray crystallography.
• GRONOWITZ S.; ANDER I., TETRAHEDRON <TETR-AB>, 1976, 32, NO 12, 1403-1406
  作者：GRONOWITZ S.、 ANDER I.

  DOI：——

  日期：——