(R)-alpha-[[[(Phenylmethoxy)carbonyl]amino]oxy]-benzenepropanoic Acid | 49857-06-9

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 苯丙酸
• 英文名称: (R)-alpha-[[[(Phenylmethoxy)carbonyl]amino]oxy]-benzenepropanoic Acid
• 英文别名: (2R)-3-phenyl-2-(phenylmethoxycarbonylaminooxy)propanoic acid
• CAS: 49857-06-9
• 化学式: C₁₇H₁₇NO₅
• 分子量: 315.326
• InChiKey: IFIDDJPVCPJIQZ-OAHLLOKOSA-N

物化性质

• 密度：
  1.281±0.06 g/cm3(Predicted)
• 溶解度：
  可溶于乙酸乙酯

计算性质

• 辛醇/水分配系数(LogP)：
  3.1
• 重原子数：
  23
• 可旋转键数：
  8
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  84.9
• 氢给体数：
  2
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  L-苯丙氨酸 在 硫酸 、 sodium hydride 、 potassium bromide 、 sodium nitrite 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 生成 (R)-alpha-[[[(Phenylmethoxy)carbonyl]amino]oxy]-benzenepropanoic Acid
  参考文献：
  名称：

  Briggs,M.T.; Morley,J.S., Journal of the Chemical Society. Perkin transactions I, 1979, p. 2138 - 2143

  摘要：

  DOI：

文献信息

• [EN] NOVEL BICYCLIC COMPOUNDS<br/>[FR] NOUVEAUX COMPOSÉS BICYCLIQUES
  申请人：PRISM BIOLAB CO LTD

  公开号：WO2022075486A1

  公开（公告）日：2022-04-14

  A compound of the formula (I): wherein each symbol is as defined in the DESCRIPTION, or a pharmaceutically acceptable salt thereof has a superior Notch signal transduction inhibitory action, and is useful for preventing or treating various diseases involving Notch signal transduction.

  公式（I）的化合物：其中每个符号如描述中定义，或其药学上可接受的盐具有优越的Notch信号转导抑制作用，并且对预防或治疗涉及Notch信号转导的各种疾病有用。
• Synthesis and Characterization of Chiral N−O Turns Induced by α-Aminoxy Acids
  作者：Dan Yang、Bing Li、Fei-Fu Ng、Yi-Long Yan、Jin Qu、Yun-Dong Wu

  DOI：10.1021/jo010376a

  日期：2001.11.1

  Chiral alpha -aminoxy acids of various side chains were synthesized with high optical purity starting from chiral alpha -amino acids. The conformations of diamides 13a-e, 15, and 16 were probed by using NMR, FT-IR, and CD spectroscopic methods as well as X-ray crystallography. The right-handed turns with eight-membered-ring intramolecular hydrogen bonds between adjacent residues (called the N-O turns) were found to be preferred for D-aminoxy acid residues, and they were independent of the side chains. The rigid chiral N-O turns should have great potential in molecular design.
• Briggs,M.T.; Morley,J.S., Journal of the Chemical Society. Perkin transactions I, 1979, p. 2138 - 2143
  作者：Briggs,M.T.、Morley,J.S.

  DOI：——

  日期：——