7-methoxy-2-phenyl-chromene-4-thione | 244107-94-6

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 黄酮类化合物
• 英文名称: 7-methoxy-2-phenyl-chromene-4-thione
• 英文别名: 7-Methoxy-2-phenyl-chromen-4-thion；7-methoxy-2-phenyl-4H-chromene-4-thione；7-methoxy-2-phenylchromene-4-thione
• CAS: 244107-94-6
• 化学式: C₁₆H₁₂O₂S
• 分子量: 268.336
• InChiKey: RGSVFOYFXHGPJX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.5
• 重原子数：
  19
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.06
• 拓扑面积：
  50.6
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  7-methoxy-2-phenyl-chromene-4-thione 在 乙醇 、 一水合肼 作用下， 生成 7-methoxy-2-phenyl-chromen-4-one-hydrazone
  参考文献：
  名称：

  Baker et al., Journal of the Chemical Society, 1954, p. 998,1001

  摘要：

  DOI：
• 作为产物：
  描述：

  7-甲氧基黄酮 在 劳森试剂 作用下， 反应 0.05h， 以95%的产率得到7-methoxy-2-phenyl-chromene-4-thione
  参考文献：
  名称：

  Microwave-Accelerated Solvent-Free Synthesis of Thioketones, Thiolactones, Thioamides, Thionoesters, and Thioflavonoids

  摘要：

  [GRAPHICS]An expeditious, solvent free, and high yield conversion of ketones, flavones, isoflavones, lactones, amides, and esters to the corresponding thio analogues is described utilizing Lawesson's reagent in a process that circumvents the use of dry solvents and excess of the reagent.

  DOI：

  10.1021/ol990629a

文献信息

• 由羟基查尔酮化合物和黄原酸盐制备4-硫代黄酮化合物的方法
  申请人：苏州大学

  公开号：CN114853708A

  公开（公告）日：2022-08-05

  本发明公开了一种由羟基查尔酮化合物和黄原酸盐制备4‑硫代黄酮化合物的方法，将羟基查尔酮化合物、黄原酸盐在溶剂中反应，制备硫代黄酮化合物。鉴于4‑硫代黄酮类化合物在药物和环境领域的巨大应用潜力，开发一种简便有效的方法来制备4‑硫代黄酮非常必要，本发明由羟基查尔酮化合物和黄原酸盐制备4‑硫代黄酮化合物，解决了现有技术采用有毒试剂的问题。
• Microwave-Accelerated Solvent-Free Synthesis of Thioketones, Thiolactones, Thioamides, Thionoesters, and Thioflavonoids
  作者：Rajender S. Varma、Dalip Kumar

  DOI：10.1021/ol990629a

  日期：1999.9.1

  [GRAPHICS]An expeditious, solvent free, and high yield conversion of ketones, flavones, isoflavones, lactones, amides, and esters to the corresponding thio analogues is described utilizing Lawesson's reagent in a process that circumvents the use of dry solvents and excess of the reagent.
• A new series of flavones, thioflavones, and flavanones as selective monoamine oxidase-B inhibitors
  作者：Franco Chimenti、Rossella Fioravanti、Adriana Bolasco、Paola Chimenti、Daniela Secci、Francesca Rossi、Matilde Yáñez、Francisco Orallo、Francesco Ortuso、Stefano Alcaro、Roberto Cirilli、Rosella Ferretti、M. Luisa Sanna

  DOI：10.1016/j.bmc.2009.12.029

  日期：2010.2

  A new series of synthetic flavones, thioflavones, and flavanones has been synthesized and evaluated as potential inhibitors of monoamine oxidase isoforms (MAO-A and -B). The most active series is the flavanone one with higher selective inhibitory activity against MAO-B. Some of these flavanones (mainly the most effective) have been separated and tested as single enantiomers. In order to investigate the MAOs recognition of the most active and selective compounds, a molecular modeling study has been performed using available Protein Data Bank (PDB) structures as receptor models for docking experiments. (C) 2009 Elsevier Ltd. All rights reserved.
• Baker et al., Journal of the Chemical Society, 1954, p. 998,1001
  作者：Baker et al.

  DOI：——

  日期：——