2-amino-N-(4-iodophenyl)acetamide | 855594-21-7

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: 2-amino-N-(4-iodophenyl)acetamide
• CAS: 855594-21-7
• 化学式: C₈H₉IN₂O
• mdl: MFCD11174571
• 分子量: 276.077
• InChiKey: PNWCWXLRXGAVFL-UHFFFAOYSA-N

物化性质

• 熔点：
  155 °C
• 沸点：
  412.1±30.0 °C(Predicted)
• 密度：
  1.861±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.8
• 重原子数：
  12
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.125
• 拓扑面积：
  55.1
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2-amino-N-(4-iodophenyl)acetamide 在 potassium carbonate 、 N,N-二异丙基乙胺 作用下， 以 乙腈 为溶剂， 生成 Ethyl 2-[bis[[6-[[(2-ethoxy-2-oxoethyl)-[2-(4-iodoanilino)-2-oxoethyl]amino]methyl]-4-[2-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]ethynyl]pyridin-2-yl]methyl]amino]acetate
  参考文献：
  名称：

  [EN] NOVEL LUMINESCENT LANTHANIDE CHELATE REPORTERS, BIOSPECIFIC BINDING REACTANTS LABELLED WITH NOVEL LUMINESCENT LANTHANIDE CHELATE REPORTERS AND THEIR USE
  [FR] NOUVEAUX RAPPORTEURS LUMINESCENTS DE CHÉLATES DE LANTHANIDES, RÉACTIFS DE LIAISON BIOSPÉCIFIQUES MARQUÉS AVEC DE NOUVEAUX RAPPORTEURS LUMINESCENTS DE CHÉLATES DE LANTHANIDES ET LEUR UTILISATION

  摘要：

  本发明涉及一种新型的发光镧系螯合物报告物，它由两到三个独立的镧系螯合物基团共价结合在一起形成，作为一种独特的标记试剂，并且可以附着在生物特异性试剂上，并用于各种分析中。

  公开号：

  WO2020260384A1
• 作为产物：
  描述：

  tert-butyl 2-(4-iodophenylamino)-2-oxoethylcarbamate 在 三氟乙酸 作用下， 反应 5.0h， 以93%的产率得到2-amino-N-(4-iodophenyl)acetamide
  参考文献：
  名称：

  [EN] NOVEL LUMINESCENT LANTHANIDE CHELATE REPORTERS, BIOSPECIFIC BINDING REACTANTS LABELLED WITH NOVEL LUMINESCENT LANTHANIDE CHELATE REPORTERS AND THEIR USE
  [FR] NOUVEAUX RAPPORTEURS LUMINESCENTS DE CHÉLATES DE LANTHANIDES, RÉACTIFS DE LIAISON BIOSPÉCIFIQUES MARQUÉS AVEC DE NOUVEAUX RAPPORTEURS LUMINESCENTS DE CHÉLATES DE LANTHANIDES ET LEUR UTILISATION

  摘要：

  本发明涉及一种新型的发光镧系螯合物报告物，它由两到三个独立的镧系螯合物基团共价结合在一起形成，作为一种独特的标记试剂，并且可以附着在生物特异性试剂上，并用于各种分析中。

  公开号：

  WO2020260384A1

文献信息

• A direct fixation of CO₂ for isotopic labelling of hydantoins using iodine–phosphine charge transfer complexes
  作者：John-Paul J. Bow、Valentina Adami、Agostino Marasco、Gaute Grønnevik、Dean A. Rivers、Guiseppe Alvaro、Patrick J. Riss

  DOI：10.1039/d2cc01754g

  日期：——

  Herein, we report a method for the isotopic labelling of hydantoins directly from CO2 by means of trimethyl-λ5-phosphine diiodide mediated carbonyl insertion. The method is suitable for 13C-labelling of diverse substrates and was implementated for 11C-labelling in PET-imaging facilities for the synthesis of radiotracers. Isolated yields of 90% and radiochemical yields of 89% were achieved for hydantoin

  在此，我们报道了一种通过三甲基-λ 5 -二碘化膦介导的羰基插入直接从 CO 2中同位素标记乙内酰脲的方法。该方法适用于不同底物的13 C-标记，并在 PET 成像设备中用于11 C-标记，用于合成放射性示踪剂。制剂中含有乙内酰脲的候选药物在 30 分钟内实现了 90% 的分离产率和 89% 的放射化学产率，具有高摩尔活性 (>400 MBq nmol -1 )。
• Antibacterial agents
  申请人：The University of Washington

  公开号：EP2295402B1

  公开（公告）日：2015-08-12
• In silico and pharmacological screenings identify novel serine racemase inhibitors
  作者：Hisashi Mori、Ryogo Wada、Jie Li、Tetsuya Ishimoto、Mineyuki Mizuguchi、Takayuki Obita、Hiroaki Gouda、Shuichi Hirono、Naoki Toyooka

  DOI：10.1016/j.bmcl.2014.07.003

  日期：2014.8

  D-Serine is a coagonist of the N-methyl-D-aspartate (NMDA)-type glutamate receptor and its biosynthesis is catalyzed by serine racemase (SR). The overactivation of the NMDA receptor has been implicated in the development of neurodegenerative diseases, strokes, and epileptic seizures, thus, the inhibitors of SR have potential against these pathological states. Here, we have developed novel inhibitors of SR by in silico screening and in vitro enzyme assay. The newly developed inhibitors have lower IC50 value comparing with that of malonate, one of the standard SR inhibitor. The structural features of novel inhibitors suggest the importance of central amide structure having a phenoxy substituent in their structure for the SR inhibitory activity. The present findings suggest the importance and rational development of new drugs for diseases of NMDAR overactivation.
• Charge Transfer Chromophore-Stopped [2]Rotaxane through [2 + 2] Cycloaddition
  作者：Weidong Zhou、Jialiang Xu、Haiyan Zheng、Huibiao Liu、Yuliang Li、Daoben Zhu

  DOI：10.1021/jo8014566

  日期：2008.10.3

  Three charge-transfer chromophore-terminated [2]rotaxanes were synthesized, using a high-yield [2 + 2]cycloaddition reaction in apolar solvent at room temperature. Two solvent-driving molecular shuttles were constructed, which exhibit distinct conformations in different solvent as a result of the shuttling movement of the macrocycle.
• SUBSTITUTED BENZO DE]ISOQUINOLINE-1,3-DIONES
  申请人：MERCK PATENT GmbH

  公开号：EP1133475A1

  公开（公告）日：2001-09-19