N-(2,4-二氯苯基)丙二酸 | 17722-30-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: N-(2,4-二氯苯基)丙二酸
• 英文名称: N-(2,4-dichlorophenyl)malonamic acid
• 英文别名: N-malonyl-2,4-dichloroaniline；N-(2,4-dichloro-phenyl)-malonamic acid；N-(2,4-Dichlor-phenyl)-malonamidsaeure；Malonsaeure-mono-(2.4-dichlor-anilid)；2.4-Dichlor-malonanilsaeure；α-(2,4-Dichlor-phenylcarbamoyl)-essigsaeure；3-(2,4-Dichloroanilino)-3-oxopropanoic acid
• CAS: 17722-30-4
• 化学式: C₉H₇Cl₂NO₃
• 分子量: 248.065
• InChiKey: PZFOYQMHPXPSPA-UHFFFAOYSA-N

物化性质

• 熔点：
  164 °C (decomp)
• 沸点：
  489.2±45.0 °C(Predicted)
• 密度：
  1.574±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.4
• 重原子数：
  15
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.11
• 拓扑面积：
  66.4
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  N-(2,4-二氯苯基)丙二酸 生成 2,4-二氯乙酰苯胺
  参考文献：
  名称：

  Chattaway; Mason, Journal of the Chemical Society, 1910, vol. 97, p. 344

  摘要：

  DOI：
• 作为产物：
  描述：

  3-(2,4-二氯苯胺基)-3-氧代丙酸乙酯 生成 N-(2,4-二氯苯基)丙二酸
  参考文献：
  名称：

  Chattaway; Mason, Journal of the Chemical Society, 1910, vol. 97, p. 344

  摘要：

  DOI：

文献信息

• [EN] SPECIFIC INHIBITORS OF METHIONYL-TRNA SYNTHETASE<br/>[FR] INHIBITEURS SPÉCIFIQUES DE LA MÉTHIONYL-TARN SYNTHÉTASE
  申请人：UNIV WASHINGTON

  公开号：WO2016029146A1

  公开（公告）日：2016-02-25

  The present disclosure is generally directed to compositions useful in the inhibition of MetRS and methods for treating diseases that are ameliorated by the inhibition of MetRS.

  本公开涉及的是通常用于抑制MetRS的组合物和治疗通过抑制MetRS改善的疾病的方法。
• A Convenient one-pot synthesis of n-arylmalonamic acid via in-situ generation of malonyl monoacyl chloride
  作者：Hsiencheng Shih、Gary O Rankin

  DOI：10.1080/00397919608086760

  日期：1996.2

  Abstract A convenient one-pot synthesis of N-arylmalonamic acid has been demonstrated based on the in-situ generation ofmalonyl monoacyl chloride, followed by reaction with aniline.

  摘要 基于丙二酰单酰氯的原位生成，然后与苯胺反应，已经证明了一种方便的 N-芳基丙二酸的一锅法合成。
• Specific inhibitors of methionyl-tRNA synthetase
  申请人：UNIVERSITY OF WASHINGTON

  公开号：US10913736B2

  公开（公告）日：2021-02-09

  The present disclosure is generally directed to compositions useful in the inhibition of MetRS and methods for treating diseases that are ameliorated by the inhibition of MetRS.

  本公开总体上涉及可用于抑制 MetRS 的组合物，以及通过抑制 MetRS 改善疾病的治疗方法。
• β-C-Mannosides as Selectin Inhibitors
  作者：Neelu Kaila、Lihren Chen、Thomas、Desiree Tsao、Steve Tam、Patricia W. Bedard、Raymond T. Camphausen、Juan C. Alvarez、Giliyar Ullas

  DOI：10.1021/jm010390f

  日期：2002.4.1

  Potential E- and P-selectin inhibitors were synthesized to explore a hydrophobic area on the E-selectin surface and the PSGL-1 protein binding site on the P-selectin surface that was recently defined by crystallography. Three series of mannose-based compounds (libraries A, B, and C) were synthesized using solution phase parallel synthesis. Biological evaluation of these compounds was done using two ELISA-based assays and transferred NOE (trNOE) experiments. Some of the compounds showed better activity than sLe(x) in the P-selectin assay.
• Chattaway; Mason, Journal of the Chemical Society, 1910, vol. 97, p. 344
  作者：Chattaway、Mason

  DOI：——

  日期：——