2-(1-oxo-1H-2,3-dihydroisoindol-2-yl)-3-imidazolyl-L-lactamic acid | 1456806-22-6

• 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-(1-oxo-1H-2,3-dihydroisoindol-2-yl)-3-imidazolyl-L-lactamic acid
• 英文别名: PLH；(2S)-3-(1H-imidazol-5-yl)-2-(3-oxo-1H-isoindol-2-yl)propanoic acid
• CAS: 1456806-22-6
• 化学式: C₁₄H₁₃N₃O₃
• 分子量: 271.276
• InChiKey: LGUDCCVMCMQDTN-LBPRGKRZSA-N

物化性质

• 沸点：
  632.0±55.0 °C(predicted)
• 密度：
  1.465±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.06
• 重原子数：
  20.0
• 可旋转键数：
  4.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.21
• 拓扑面积：
  86.29
• 氢给体数：
  2.0
• 氢受体数：
  3.0

反应信息

• 作为产物：
  描述：

  (2S)-2-[1-(2-hydroxyethylsulfanyl)isoindol-2-yl]-3-(1H-imidazol-5-yl)propanoic acid 生成 2-(1-oxo-1H-2,3-dihydroisoindol-2-yl)-3-imidazolyl-L-lactamic acid
  参考文献：
  名称：

  FRISTER, H.;MEISEL, H.;SCHLIMME, E., FRESENIUS Z. ANAL. CHEM., 330,(1988) N 7, 631-633

  摘要：

  DOI：

文献信息

• Synthesis, structure, optical properties, antifungal and antibacterial activities of 2-(1-oxo-1H-2,3-dihydroisoindol-2-yl)-3-imidazolyl-L-lactamic acid
  作者：Ting Jia、Wei-Long Zhang、Yun Chen、Shuang-Lian Cai、Hai-Bo Yi

  DOI：10.1016/j.molstruc.2013.07.034

  日期：2013.10

  2-(1-oxo-1H-2,3-dihydroisoindol-2-yl)-3-imidazolyl-L-lactamic acid has been prepared conveniently by the condensation reaction of o-phthalaldehyde (OPA) with L-Histidine, and its single crystal structure has been characterized by X-ray crystallography method. The in vitro antifungal and antibacterial activities of the compound were investigated with the representative strains of Candida albicans, Staphylococcus aureus, Escherichia coli and Pseudomonas aeruginosa. Its luminescent and nonlinear optical properties have also been investigated. Second-harmonic-generation (SHG) measurements indicate that compound 1 displays a weak SHG response of about 0.75 times that of KH2PO4. (C) 2013 Elsevier B.V. All rights reserved.
• STEGEHUIS, D. S.;IRTH, H.;TJADEN, U. R.;VAN, DER GREEF J., J. CHROMATOGR., 538,(1991) N, C. 393-402
  作者：STEGEHUIS, D. S.、IRTH, H.、TJADEN, U. R.、VAN, DER GREEF J.

  DOI：——

  日期：——