2-(4-氨基苯基)-1-苯乙酮 | 2440-20-2

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 二苯乙烯类
• 中文名称: 2-(4-氨基苯基)-1-苯乙酮
• 英文名称: 2-(4-aminophenyl)-1-phenylethanone
• 英文别名: 2-(4-aminophenyl)-1-phenylethan-1-one；4-amino-1,2-diphenylethanone；4'-amino-deoxybenzoin；4'-Amino-desoxybenzoin；Phenyl-(4-amino-benzyl)-keton；p-Amino-benzyl-phenylketon
• CAS: 2440-20-2
• 化学式: C₁₄H₁₃NO
• 分子量: 211.263
• InChiKey: XBDWIJCZQWUMMU-UHFFFAOYSA-N

物化性质

• 溶解度：
  0.02 M

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  16
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  43.1
• 氢给体数：
  1
• 氢受体数：
  2

安全信息

• 海关编码：
  2922399090

反应信息

• 作为反应物：
  描述：

  2-(4-氨基苯基)-1-苯乙酮 在 吡啶 、 sodium tetrahydroborate 作用下， 以 甲醇 、 二氯甲烷 为溶剂， 生成 2-chloro-N-[4-(2-hydroxy-2-phenylethyl)phenyl]benzamide
  参考文献：
  名称：

  Discovery of amide replacements that improve activity and metabolic stability of a bis-amide smoothened antagonist hit

  摘要：

  A bis-amide antagonist of Smoothened, a seven-transmembrane receptor in the Hedgehog signaling pathway, was discovered via high throughput screening. In vitro and in vivo experiments demonstrated that the bis-amide was susceptible to N-acyl transferase mediated amide scission. Several bioisosteric replacements of the labile amide that maintained in vitro potency were identified and shown to be metabolically stable in vitro and in vivo. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2011.07.052
• 作为产物：
  描述：

  2-(4-硝基苯基)乙酰氯 在 盐酸 、 三氯化铝 、 铁粉 、 苯 作用下， 生成 2-(4-氨基苯基)-1-苯乙酮
  参考文献：
  名称：

  Lespagnol; Cheymol; Soleil, Bulletin de la Societe Chimique de France, 1947, p. 480

  摘要：

  DOI：

文献信息

• Copper-catalyzed aerobic oxygenative cross dehydrogenative coupling of methyl ketones with para-C–H of primary anilines
  作者：Xiaochen Ji、Dongdong Li、Xuan Zhou、Huawen Huang、Guo-Jun Deng

  DOI：10.1039/c6gc02271e

  日期：——

  A novel oxygenative cross dehydrogenative coupling of methyl ketones with para-C-H of primary anilines under copper/oxygen catalytic system is discribed. This methodology features advantages including readily available starting materials, green...

  描述了在铜/氧催化体系下甲基酮与伯苯胺的对-CH的新型氧交叉脱氢偶联。该方法具有许多优势，包括容易获得的原材料，绿色...
• Azobenzene-Semicarbazone Enables Optical Control of Insect Sodium Channels and Behavior
  作者：Zhi Qiao、Wen Fu、Yongchao Zhang、Ruijia Chen、Zhiping Xu、Zhong Li、Xusheng Shao

  DOI：10.1021/acs.jafc.1c06404

  日期：2021.12.29

  Photopharmacology uses molecular photoswitches to establish control over the action of bioactive molecules. The application of photopharmacology in the research of invertebrate sodium channels has not been investigated. Here we report several photochromic ligands of metaflumizone. One ligand, termed ABM04, underwent reversible trans–cis isomerization under ultraviolet or blue light irradiation. cis-ABM04

  光药理学使用分子光开关来控制生物活性分子的作用。光药理学在无脊椎动物钠通道研究中的应用尚无研究。在这里我们报告了氰氟虫腙的几种光致变色配体。一种称为ABM04 的配体在紫外线或蓝光照射下经历了可逆的反式-顺式异构化。cis -ABM04对蚊子幼虫具有优异的杀幼虫活性，LC 50值为 4.39 μM，对Mythimna separata具有杀虫活性，LC 50值为 7.19 μM。然而，反ABM04未发现具有生物活性。ABM04 (10 μM) 可以诱导背侧未配对的正中神经元去极化，并使蚊子幼虫行为的实时光调节成为可能。首次实现了对无脊椎动物钠通道的精准调控，为无脊椎动物钠通道的基础精准研究提供了新的思路。
• Efficient One‐Pot Friedel–Crafts Acylation of Benzene and its Derivatives with Unprotected Aminocarboxylic Acids in Polyphosphoric Acid
  作者：Iliyan Ivanov、Stoyanka Nikolova、Stela Statkova‐Abeghe

  DOI：10.1080/00397910500522124

  日期：2006.6.1

  Abstract A number of aminobenzophenones have been synthesized by acylation of benzene and its derivatives with different 2‐,3‐,4‐aminobenzoic and 4‐aminophenylacetic acids in polyphosphoric acid via Friedel–Crafts reaction as compounds with expected antitumor activity.

  摘要 苯及其衍生物与多磷酸中不同的 2-,3-,4-氨基苯甲酸和 4-氨基苯乙酸通过 Friedel-Crafts 反应酰化合成了许多氨基二苯甲酮，作为具有预期抗肿瘤活性的化合物。
• Selective Metal-Free Deoxygenation of Unsymmetrical 1,2-Dicarbonyl Compounds by Chlorotrimethylsilane and Sodium Iodide
  作者：Ling-Zhi Yuan、Dolor Renko、Ilhem Khelifi、Olivier Provot、Jean-Daniel Brion、Abdallah Hamze、Mouad Alami

  DOI：10.1021/acs.orglett.6b01491

  日期：2016.7.1

  For the first time, the combination of chlorotrimethylsilane with NaI is used as a selective reducting system toward 1,2-diketones. This combination is successfully evaluated with several unsymmetrically benzil derivatives, which are reduced in good yields and with a total α-regioselectivity at room temperature. Identification of benzoin intermediates is achieved, and a mechanistic radical process

  首次将氯三甲基硅烷与NaI的组合用作对1,2-二酮的选择性还原体系。用几种不对称的苯甲腈衍生物成功评估了这种组合，这些衍生物以良好的收率降低，在室温下具有总的α-区域选择性。实现了对安息香中间体的鉴定，并提出了机理自由基过程。
• ASSAY METHOD UTILIZING POLYNUCLEOTIDE SEQUENCES
  申请人：PERGOLIZZI ROBERT

  公开号：US20100273145A1

  公开（公告）日：2010-10-28

  A method of detecting in a sample an analyte (A) having a molecularly recognizable portion thereon, which comprises: providing (B) a molecular bridging entity having thereon: (i) a portion capable of recognizing the molecularly recognizable portion on the analyte; and (ii) a portion comprising a polynucleotide sequence; and (C) a signalling entity having thereon: (i) a polynucleotide portion capable of annealing to the polynucleotide portion of the bridging entity, thereby to form a stable polynucleotide hybrid, and (ii) a signal generating portion; forming a complex comprising: (1) the analyte (A) complexed through its molecularly recognizable portion to (2) the recognizing portion of the entity (B); the entity (B) being complexed through the polynucleotide portion thereon to (3) the polynucleotide portion of the signalling entity; and detecting a signal by means of the signal generating portion present in the complex.

  一种检测样品中具有分子可识别部分的分析物（A）的方法，其包括：提供（B）具有以下内容的分子桥接实体：（i）能够识别分析物上的分子可识别部分的部分；和（ii）包含多核苷酸序列的部分；以及（C）具有以下内容的信号实体：（i）能够与桥接实体的多核苷酸部分互相结合，从而形成稳定的多核苷酸杂交体的多核苷酸部分；和（ii）信号生成部分；形成复合物，其中包括：（1）经其分子可识别部分与（2）实体（B）的识别部分络合的分析物（A）；实体（B）通过其上的多核苷酸部分与（3）信号实体的多核苷酸部分络合；并通过在复合物中存在的信号生成部分检测信号。