2-Methylmercapto-4-methyl-1,3-thiazol-5-ylacetic acid | 77446-99-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 2-Methylmercapto-4-methyl-1,3-thiazol-5-ylacetic acid
• 英文别名: 2-[4-Methyl-2-(methylsulfanyl)-1,3-thiazol-5-yl]acetic acid；2-(4-methyl-2-methylsulfanyl-1,3-thiazol-5-yl)acetic acid
• CAS: 77446-99-2
• 化学式: C₇H₉NO₂S₂
• mdl: MFCD08262837
• 分子量: 203.286
• InChiKey: GOJQXKIEZOXVJX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  12
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.428
• 拓扑面积：
  104
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  Methyl 2-methylmercapto-4-methyl-1,3-thiazol-5-ylacetate 生成 2-Methylmercapto-4-methyl-1,3-thiazol-5-ylacetic acid
  参考文献：
  名称：

  摘要：

  DOI：

文献信息

• Cephalosporin compounds comprising a C3 thio-methyl moiety substituted with N-containing heterocyclic group, and a C7 thiourea acetamido group, their preparations and uses thereof
  申请人：Chen Mao

  公开号：US20080182836A1

  公开（公告）日：2008-07-31

  Disclosed herein are a cephalosporin compound comprising a C3 thio-methyl moiety substituted with an N-containing heterocyclic group, and a C7 thiourea acetamido group, the preparation and uses thereof. A method of preparing the cephalosporin compound as disclosed herein comprises reacting a starting cephalosporin comprising a C7 amino group and a C3 thio-methyl moiety substituted with an N-containing heterocyclic group with bromoacetyl bromide and then with a N,N′-bissubstituted thiourea. Methods of treating an infectious disease are also disclosed, comprising administering to a patient in need thereof the pharmaceutical composition disclosed herein.

  本发明公开了一种头孢菌素化合物，其包含一个被N-含杂环基团取代的C3硫甲基部分和一个C7硫脲乙酰氨基团，以及其制备方法和用途。制备所述头孢菌素化合物的方法包括：使一种起始头孢菌素（其包含一个C7氨基团和一个被N-含杂环基团取代的C3硫甲基部分）与溴乙酰溴反应，随后与N,N′-双取代硫脲反应。还公开了治疗感染性疾病的方法，包括向有需要的患者施用本发明所述的药物组合物。
• Prodrugs
  申请人：MEDIVIR AB

  公开号：US20030186924A1

  公开（公告）日：2003-10-02

  A method for treatment of HBV and HIV infections comprising administering the compound or salt of formula Ig 1

  一种治疗HBV和HIV感染的方法，包括给予化合物或公式Ig1的盐。
• Antiviral methods employing double esters of 2', 3'-dideoxy-3'-fluoroguanosine
  申请人：Zhou Xiao-Xiong

  公开号：US20060122383A1

  公开（公告）日：2006-06-08

  A method for treatment of HBV and HIV infections comprising administering the compound or salt of formula Ig

  一种治疗HBV和HIV感染的方法，包括给予化合物或公式Ig的盐。
• ANTIVIRAL METHODS EMPLOYING DOUBLE ESTERS OF 2', 3'-DIDEOXY-3'-FLUOROGUANOSINE
  申请人：Zhou Xiao-Xiong

  公开号：US20060058259A1

  公开（公告）日：2006-03-16

  A method for treatment of HBV and HIV infections comprising administering the compound or salt of formula Ig

  一种治疗乙型肝炎和人类免疫缺陷病毒感染的方法，包括给予公式Ig的化合物或盐。
• Derivative having ppar agonistic activity
  申请人：Itai Akiko

  公开号：US20090286974A1

  公开（公告）日：2009-11-19

  A compound of the formula (I): a pharmaceutically acceptable salt or solvate thereof, wherein Ring Q is optionally substituted monocyclic aryl, optionally substituted monocyclic heteroaryl, optionally substituted fused aryl or optionally substituted fused heteroaryl, Y 1 is a bond or —NR 6 — or the like, Ring A is optionally substituted nonaromatic heterocyclediyl, a group of the formula: -Y 2 Z 1 - is a group of the formula: R 7 are each independently hydrogen, optionally substituted lower alkyl or the like, R 8 and R 9 are each independently hydrogen or optionally substituted lower alkyl, n is an integer between 1 and 3, Z 1 is a bond, —O—, —S— or —NR 9 —, Ring B is optionally substituted aromatic carbocyclediyl or optionally substituted aromatic heterocyclediyl, Y 3 is a bond, optionally substituted lower alkylene optionally intervened by —O—, optionally substituted lower alkenylene or the like, and Z 2 is COOR 3 or the like.

  化合物的公式（I）：其药物可接受的盐或溶剂，其中环Q是可选择的取代的单环芳基，可选择的取代的单环杂芳基，可选择的融合芳基或可选择的融合杂芳基，Y1是键或-NR6-或类似物，环A是可选择的取代的非芳香杂环二基，公式组：-Y2Z1-是公式组：R7各自独立地是氢，可选择的取代的低烷基或类似物，R8和R9各自独立地是氢或可选择的取代的低烷基，n是1到3之间的整数，Z1是键，-O-，-S-或-NR9-，环B是可选择的取代的芳香碳杂环二基或可选择的取代的芳香杂环二基，Y3是键，可选择的取代的低烷基，可选择地介入-O-，可选择的取代的低烯基或类似物，并且Z2是COOR3或类似物。