3-(3-甲氧基苯基)-5-甲基异恶唑-4-羧酸乙酯 | 22888-50-2

• 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
• 中文名称: 3-(3-甲氧基苯基)-5-甲基异恶唑-4-羧酸乙酯
• 英文名称: 4-Aminocarbamoylphenylalanin
• 英文别名: p-Carbamoyl-phenylalanin；2-azaniumyl-3-(4-carbamoylphenyl)propanoate
• CAS: 22888-50-2
• 化学式: C₁₀H₁₂N₂O₃
• 分子量: 208.217
• InChiKey: OZVAXCWACWDNIQ-UHFFFAOYSA-N

物化性质

• 沸点：
  444.6±40.0 °C(Predicted)
• 密度：
  1.333±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  -1.6
• 重原子数：
  15
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  111
• 氢给体数：
  2
• 氢受体数：
  3

文献信息

• SYNTHESIS, STRUCTURE AND USE OF BISOXAZOLIDINES FOR ASYMMETRIC CATALYSIS AND SYNTHESIS
  申请人：Wolf Christian

  公开号：US20070265255A1

  公开（公告）日：2007-11-15

  One aspect of the invention relates to chiral bisoxazolidines and their use in asymmetric catalysis. The chiral bisoxazolidines are a novel class of compounds that is expected to find multiple applications, for example, in asymmetric synthesis. For example, a bisoxazolidine ligand enabled the catalytic enantioselective alkynylation and alkylation of a range of aromatic and aliphatic aldehydes, generating chiral propargylic alcohols and secondary alcohols in high yields and enantiomeric excess.

  该发明的一个方面涉及手性双恶唑啉及其在不对称催化中的应用。这种手性双恶唑啉是一种新型化合物类，预计将在多个领域得到应用，例如在不对称合成中。例如，一种双恶唑啉配体使得对一系列芳香族和脂肪族醛的催化不对称炔基化和烷基化成为可能，产生高产率和对映选择性的手性丙炔醇和二级醇。
• [EN] FAP-ACTIVATED THERAPEUTIC AGENTS, AND USES RELATED THERETO<br/>[FR] AGENTS THÉRAPEUTIQUES ACTIVÉS PAR FAP, ET UTILISATIONS ASSOCIÉES
  申请人：TUFTS COLLEGE

  公开号：WO2015192123A1

  公开（公告）日：2015-12-17

  Disclosed are prodrugs of cytotoxic anthracyclines (such as doxorubicin) and other therapeutic agents that are selectively cleaved and activated by fibroblast activating protein (FAP). The prodrugs are useful for targeted delivery of cytotoxic and other agents to FAP- expressing tissues, including cancer (e.g., solid tumors). Also provided are pharmaceutical compounds comprising the prodrugs, as well as methods of using the prodrugs to treat a disorder characterized by FAP upregulation, e.g., cancer, fibrosis, and inflammation.

  本文披露了细胞毒性蒽环类似物（如阿霉素）和其他治疗剂的前药，这些前药通过成纤维细胞激活蛋白（FAP）选择性地被切割和激活。这些前药可用于将细胞毒性和其他药物靶向输送至表达FAP的组织，包括癌症（如实体肿瘤）。还提供了包含这些前药的药物化合物，以及使用这些前药治疗由FAP上调引起的疾病的方法，例如癌症、纤维化和炎症。
• [EN] COMPOSITIONS AND METHODS FOR INHIBITING VIRAL POLYMERASE<br/>[FR] COMPOSITIONS ET PROCÉDÉS D'INHIBITION D'UNE POLYMÉRASE VIRALE
  申请人：BIOCRYST PHARM INC

  公开号：WO2013158746A1

  公开（公告）日：2013-10-24

  Provided are compounds of Formula (I) as described herein. Compounds of Formula (I) are useful in methods of inhibiting viral RNA polymerase activity and viral replication. Also provided are pharmaceutical compositions comprising compounds of Formula (I), as well as methods of treating viral infections using compounds of Formula (I).

  本文描述的是Formula (I)的化合物。Formula (I)的化合物在抑制病毒RNA聚合酶活性和病毒复制的方法中很有用。还提供了包含Formula (I)化合物的药物组合物，以及使用Formula (I)化合物治疗病毒感染的方法。
• Melanocortin Receptor-Specific Peptides
  申请人：AstraZeneca AB

  公开号：US20150252077A1

  公开（公告）日：2015-09-10

  The invention relates to melanocortin receptor-specific cyclic peptides of Formula (I) or a pharmaceutically acceptable salt thereof, where R 1 , R 2 , R 3 , R 4a , R 4b , R 4c , R 5 , x and y are as defined in the specification. These compounds are particularly useful in the treatments of energy homeostasis and metabolism related (e.g. diabetes), food intake related and/or energy balance and body weight related diseases, disorders and/or conditions, including obesity, overweight and diseases, disorders and/or conditions associated with obesity and/or overweight, such as type 2 diabetes and metabolic syndrome.

  本发明涉及公式（I）的黑素皮质素受体特异性环肽或其药学上可接受的盐，其中R1、R2、R3、R4a、R4b、R4c、R5、x和y如规范中所定义。这些化合物在能量稳态和代谢相关（例如糖尿病）、食物摄入相关和/或能量平衡和体重相关的疾病、疾病和/或状况，包括肥胖、超重以及与肥胖和/或超重相关的疾病、疾病和/或状况的治疗中特别有用，例如2型糖尿病和代谢综合征。
• [EN] DIAMINE-LINKED RECEPTOR-SPECIFIC CYCLIC PEPTIDES<br/>[FR] PEPTIDES CYCLIQUES SPÉCIFIQUES DU RÉCEPTEUR LIÉ À LA DIAMINE
  申请人：PALATIN TECHNOLOGIES INC

  公开号：WO2021158463A1

  公开（公告）日：2021-08-12

  Receptor-specific cyclic peptides of the formula (I), where Xaa¹, Xaa² Xaa³, x, R1, R2, Rs and R4 are as defined in the specification, compositions and formulations including the peptides of the foregoing formula, and methods of preventing, ameliorating or treating melanocortin receptor-mediated diseases, indications, conditions and syndromes utilizing melanocortin receptor-specific cyclic peptides of formula (I).

  公式（I）中的受体特异性环肽，其中Xaa¹，Xaa²，Xaa³，x，R1，R2，Rs和R4如规范中所定义，包括上述公式的肽的组合物和配方，以及利用公式（I）的黑色素皮质素受体特异性环肽预防，改善或治疗黑色素皮质素受体介导的疾病，适应症，状况和综合症的方法。