Oxo-(3-phenoxy-phenyl)-acetic acid methyl ester | 96747-14-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: Oxo-(3-phenoxy-phenyl)-acetic acid methyl ester
• 英文别名: Methyl 2-oxo-2-(3-phenoxyphenyl)acetate
• CAS: 96747-14-7
• 化学式: C₁₅H₁₂O₄
• 分子量: 256.258
• InChiKey: NWMJOSABSAXKII-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.1
• 重原子数：
  19
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  52.6
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  (4S,14S)-4,14-dibenzyl-19-methyl-6,9,12-trioxa-2,5,13,16-tetraoxo-3,15,19-triazabicyclo<15.3.1>heneicosa-17,20-diene 、 Oxo-(3-phenoxy-phenyl)-acetic acid methyl ester 以55%的产率得到
  参考文献：
  名称：

  TALMA, A. G.;JOUIN, P.;DE, VRIES, J. G.;TROOSTWIJK, C. B.;BUNING, G. H. W+, J. AMER. CHEM. SOC., 1985, 107, N 13, 3981-3997

  摘要：

  DOI：

文献信息

• Reductions of activated carbonyl compounds with chiral-bridged 1,4-dihydropyridines. An investigation of scope and structural effects
  作者：Auke G. Talma、Patrick Jouin、Johannes G. De Vries、C. B. Troostwijk、Gerard H. Werumeus Buning、Jan K. Waninge、Johnny Visscher、Richard M. Kellogg

  DOI：10.1021/ja00299a038

  日期：1985.6

  bridged macrocyclic 1,4-dihydropyridines (7) have been synthesized by starting from valine, alanine, phenylglycine, phenylalanine, and proline. Various bridges of different compositions, lengths, and shapes have been incorporated. All these bridged compounds in a nonprotic solvent like CH3CN in the presence of a stoichiometric amount of Mg(ClO4)2·1.5H2O reduce activated carbonyl compounds to the corresponding

  已经制备了一系列手性桥接大环 1,4-二氢吡啶，并研究了这些化合物对映选择性还原的潜力。典型的合成以吡啶-3-5-二羧酸 (9, W = OH) 开始，它与 (S)-缬氨酸偶联以最终生成双偶联产物 10 (X = OH)。将其转化为双（羧酸铯）并使其在二甲基甲酰胺 (DMF) 溶液中以 10-2 至 5 × 10-3 M 的浓度与 1,5-二溴-3-氧戊烷反应。大环 11a (R = CH(CH3)2) 的产率为 48%。随后用 CH3I/Mg(ClO4)2·1.5H2O 甲基化生成高氯酸吡啶鎓，然后用 Na2S2O4 将其还原为 1,4-二氢吡啶。以这种方式，从缬氨酸、丙氨酸、苯甘氨酸、苯丙氨酸和脯氨酸。各种不同成分、长度和形状的桥都被合并了。在化学计量的 Mg(ClO4)2·1.5H2O 存在下，所有这些桥接化合物在非质子溶剂如 CH3CN 中将活性羰基化合物还原为相应的醇；形成相应的
• Aryl–indolyl maleimides as inhibitors of CaMKIIδ. Part 1: SAR of the aryl region
  作者：Daniel E. Levy、Dan-Xiong Wang、Qing Lu、Zheng Chen、John Perumattam、Yong-jin Xu、Albert Liclican、Jeffrey Higaki、Hanmin Dong、Maureen Laney、Babu Mavunkel、Sundeep Dugar

  DOI：10.1016/j.bmcl.2008.02.059

  日期：2008.4

  A family of aryl-substituted maleimides was prepared and studied for their activity against calmodulin dependant kinase. Inhibitory activities against the enzyme ranged from 34 nM to > 20 mu M and were dependant upon both the nature of the aryl group and the hydrogen bond donating potential of the maleimide ring. Key interactions with the kinase ATP site and hinge region were found to be consistent with homology modeling predictions. (C) 2008 Elsevier Ltd. All rights reserved.
• Asymmetric reductions with 1,4-dihydropyridines contained in chiral macrocycles
  作者：Patrick Jouin、Coos B. Troostwijk、Richard M. Kellogg

  DOI：10.1021/ja00398a037

  日期：1981.4
• TALMA, A. G.;JOUIN, P.;DE, VRIES, J. G.;TROOSTWIJK, C. B.;BUNING, G. H. W+, J. AMER. CHEM. SOC., 1985, 107, N 13, 3981-3997
  作者：TALMA, A. G.、JOUIN, P.、DE, VRIES, J. G.、TROOSTWIJK, C. B.、BUNING, G. H. W+

  DOI：——

  日期：——