α-(p-bromophenylamino)isobutyronitrile | 42419-43-2

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: α-(p-bromophenylamino)isobutyronitrile
• 英文别名: 2-(4-Bromoanilino)-2-methylpropanenitrile
• CAS: 42419-43-2
• 化学式: C₁₀H₁₁BrN₂
• mdl: MFCD00968187
• 分子量: 239.115
• InChiKey: QTBHIBGEPOTWGH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  13
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  35.8
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  α-(p-bromophenylamino)isobutyronitrile 以52%的产率得到(4-Bromophen-1-yl)(1-methylethylidene)amine
  参考文献：
  名称：

  Prosyanik, A. V.; Kol'tsov, N. Yu.; Romanchenko, V. A., Journal of Organic Chemistry USSR (English Translation), 1986, vol. 22, # 7, p. 1330 - 1337

  摘要：

  DOI：
• 作为产物：
  描述：

  丙酮氰醇 、 4-溴苯胺 以 乙醇 为溶剂， 反应 4.0h， 以52%的产率得到α-(p-bromophenylamino)isobutyronitrile
  参考文献：
  名称：

  Prosyanik, A. V.; Kol'tsov, N. Yu.; Romanchenko, V. A., Journal of Organic Chemistry USSR (English Translation), 1986, vol. 22, # 7, p. 1330 - 1337

  摘要：

  DOI：

文献信息

• New insight into the chemistry of selenoureas: synthesis and single crystal structural study of diverse derivatives
  作者：Guoxiong Hua、Junyi Du、Cameron L. Carpenter-Warren、David B. Cordes、Alexandra M. Z. Slawin、J. Derek Woollins

  DOI：10.1039/c9nj01059a

  日期：——

  Reacting benzoyl chloride with KSeCN in acetone at room temperature, followed by treatment in situ with 4-bromoaniline led to N-((4-bromophenyl)carbamoselenoyl)benzamide in 93% yield. The same reaction was observed for 4-methoxybenzoyl chloride and 4-pentafluorosulfanylaniline, leading to N-((4-pentafluorosulfanylphenyl)carbamoselenoyl)-4-methoxybenzamide in 76% yield. Interestingly, under the same

  在室温下，使苯甲酰氯与KSeCN在丙酮中反应，然后用4-溴苯胺原位处理，以93％的收率得到N -（（4-溴苯基）氨基甲硒烯酰基）苯甲酰胺。对于4-甲氧基苯甲酰氯和4-五氟硫烷基苯胺观察到相同的反应，导致N-（（4-五氟硫烷基苯基）氨基甲硒烯酰基）-4-甲氧基苯甲酰胺，产率为76％。有趣的是，在相同条件下，4-甲氧基苯甲酰氯和4-溴苯胺产生了意想不到的2-（（4-溴苯基）氨基）-2-甲基丙烷和6-溴-2,2,4-三甲基-1,2 -二氢喹啉，产率分别为45％和52％。此外，4-硝基苯甲酰氯与4-五氟硫烷基苯胺的等效反应以19％的产率得到另外的3-（4-硝基苯甲酰基）亚氨基-5-（4-（五氟硫烷基）苯氨基）-1，2，4-二硒唑，其产率为19％。预期的4-硝基-N -（（4-（五氟硫烷基）苯基）氨基甲硒烯酰基）苯甲酰胺，产率为79％。此外，从氮的反应中获得了一系列的五元硒杂环-酰基硒脲与各种苯甲酰
• [EN] NOVEL COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITOR, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME<br/>[FR] NOUVEAUX COMPOSÉS UTILISÉS COMME INHIBITEUR DE L'HISTONE DÉSACÉTYLASE 6 ET COMPOSITION PHARMACEUTIQUE LES COMPRENANT
  申请人：CHONG KUN DANG PHARMACEUTICAL CORP

  公开号：WO2022049496A1

  公开（公告）日：2022-03-10

  The present invention relates to a novel compound having a selective HDAC6 inhibitory activity, stereoisomers thereof, pharmaceutically acceptable salts thereof, a use thereof in preparation of a therapeutic medicament, a pharmaceutical composition containing the same, a therapeutic method using the composition, and a method for preparing the same, wherein the novel compound having the selective HDAC6 inhibitory activity is represented by chemical formula (I) below.

  本发明涉及一种具有选择性HDAC6抑制活性的新化合物、其立体异构体、药学上可接受的盐、在制备治疗药物时的用途、含有该化合物的制药组合物、使用该组合物的治疗方法以及制备该化合物的方法。其中，具有选择性HDAC6抑制活性的新化合物由下述化学式（I）表示。
• Shakhidoyatov,Kh., Journal of Organic Chemistry USSR (English Translation), 1973, vol. 9, p. 1401 - 1404
  作者：Shakhidoyatov,Kh.

  DOI：——

  日期：——
• Magnetic Solid Sulfonic Acid Decorated with Hydrophobic Regulators: A Combinatorial and Magnetically Separable Catalyst for the Synthesis of α-Aminonitriles
  作者：Akbar Mobaraki、Barahman Movassagh、Babak Karimi

  DOI：10.1021/co500022g

  日期：2014.7.14

  A three-component, Strecker reaction of a series of aldehydes or ketones, amines, and trimethylsilyl cyanide for the synthesis of alpha-aminonitriles in the presence of a catalytic amount of a magnetic solid sulfonic acid catalyst, Fe3O4@SiO2@Me&Et-PhSO3H under solvent-free conditions have been investigated. This catalyst, with a combination of hydrophobicity and acidity on the Fe3O4@SiO2 core-shell of the magnetic nanobeads, as well as its water-resistant property, enabled easy mass transfer and catalytic activity in the Strecker reaction. The catalyst was easily separated by an external magnet and the recovered catalyst was reused in 6 successive reaction cycles without any significant loss of activity.
• PROSYANIK A. V.; KOLTSOV N. YU.; ROMANCHENKO V. A., ZH. ORGAN. XIMII, 22,(1986) N 7, 1474-1482
  作者：PROSYANIK A. V.、 KOLTSOV N. YU.、 ROMANCHENKO V. A.

  DOI：——

  日期：——