N-(aminoiminomethyl)-N-methylglycine butyl ester | 404576-02-9

• 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: N-(aminoiminomethyl)-N-methylglycine butyl ester
• 英文别名: N-(aminoiminomethyl)-N-methylglycine tertiary butyl ester；(N-methyl-guanidino)acetic acid tert-butyl ester；Tert-butyl 2-[carbamimidoyl(methyl)amino]acetate
• CAS: 404576-02-9
• 化学式: C₈H₁₇N₃O₂
• 分子量: 187.242
• InChiKey: CFNMSNHSXKXMMW-UHFFFAOYSA-N

物化性质

• 沸点：
  253.0±42.0 °C(Predicted)
• 密度：
  1.09±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.1
• 重原子数：
  13
• 可旋转键数：
  5
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.75
• 拓扑面积：
  79.4
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  1-(三氟甲基)-1,2-苯碘酰-3(1H)-酮 、 N-(aminoiminomethyl)-N-methylglycine butyl ester 在 bis((1,1,1-trifluoro-N-(trifluoromethyl)sulfonyl)methylsulfonamido)zinc 双(三甲基硅烷基)氨基钾 作用下， 以 四氢呋喃 为溶剂， 反应 1.5h， 生成
  参考文献：
  名称：

  [EN] MULTIPLE SUBSTITUTED FLUOROMETHANES AS SELECTIVE AND BIOACTIVE ISOSTERES
  [FR] FLUOROMÉTHANES À SUBSTITUTIONS MULTIPLES EN TANT QU'ISOSTÈRES SÉLECTIFS ET BIOACTIFS

  摘要：

  公开号：

  WO2011097421A8

文献信息

• Method of Preparing Creatine Ester Salts and Uses Thereof
  申请人：Ferguson Chris

  公开号：US20080254198A1

  公开（公告）日：2008-10-16

  This invention discloses the method of preparation of creatine ester-salts. Creatine is an extremely popular ergogenic aid, and is found most often in the form of creatine monohydrate. Creatine monohydrate is poorly soluble in water however and while esters gain solubility, there functionality is greatly decreased. The material can be administered in a variety of ways including capsules, tablets, powdered beverages, bars, gels, liquids, liposomes or drinks.

  这项发明揭示了肌酸酯盐的制备方法。肌酸是一种极其流行的增强运动能力的辅助剂，通常以单水合肌酸盐的形式出现。然而，单水合肌酸盐在水中的溶解度很差，而酯类虽然具有溶解性，但其功能大大降低。该物质可以通过多种方式进行给药，包括胶囊、片剂、粉状饮料、棒状食品、凝胶、液体、脂质体或饮料。
• Creatine ester anti-inflammatory compounds and formulations
  申请人：Board of Regents of the University of Nebraska

  公开号：US10206897B2

  公开（公告）日：2019-02-19

  The present invention provides a creatine ester anti-inflammatory compound which may be received by animals and then metabolized into a biologically active form of creatine. The biologically active creatine inhibits the production of chemical mediators, released during an inflammatory response, which are important components in the inflammatory response and the inflammation and pain resulting from physical or chemical trauma to cells and tissue.

  本发明提供了一种肌酸酯抗炎化合物，动物可以接受这种化合物，然后将其代谢成具有生物活性的肌酸形式。生物活性肌酸可抑制炎症反应期间释放的化学介质的产生，这些介质是炎症反应以及细胞和组织受到物理或化学创伤后产生的炎症和疼痛的重要组成部分。
• CREATINE ESTER PRONUTRIENT COMPOUNDS AND FORMULATIONS
  申请人：Vennerstrom L. Jonathan

  公开号：US20070203076A1

  公开（公告）日：2007-08-30

  The present invention describes a method for providing creatine to an animal, which includes receiving a creatine ester by the animal. The creatine ester is suitable for being modified by the animal to form creatine.
• CREATINE ESTER ANTI-INFLAMMATORY COMPOUNDS AND FORMULATIONS
  申请人：Miller Donald W.

  公开号：US20090137669A1

  公开（公告）日：2009-05-28

  The present invention provides a creatine ester anti-inflammatory compound which may be received by animals and then metabolized into a biologically active form of creatine. The biologically active creatine inhibits the production of chemical mediators, released during an inflammatory response, which are important components in the inflammatory response and the inflammation and pain resulting from physical or chemical trauma to cells and tissue.
• MULTIPLE SUBSTITUTED FLUOROMETHANES AS SELECTIVE AND BIOACTIVE ISOSTERES
  申请人：Hediger Mark E.

  公开号：US20120302519A1

  公开（公告）日：2012-11-29

  Disclosed herein are substituted fluoromethanes; pharmaceutical compositions comprising a therapeutically effective amount of the same; processes for preparing these fluoromethanes; and methods of using the same in alleviating infection and parasitism. Also disclosed are methods for identifying substituted fluoromethanes for modulating the activity of receptors and enzymes that bind and/or modify phosphate containing ligands and substrates.