2-(3-(1-methyltetrazol-5-ylthio)propyl)-1H-isoindole-1,3(2H)-dione | 80085-95-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 异吲哚及其衍生物
• 英文名称: 2-(3-(1-methyltetrazol-5-ylthio)propyl)-1H-isoindole-1,3(2H)-dione
• 英文别名: N-((1-methyltetrazol-5-ylthio)propyl)phthalimide；1-Methyl-5-[3-(phthalimido)propyl]thio-1,2,3,4-tetrazole；1-Methyl-5-[3-(phthalimido)propylthio]-1,2,3,4-tetrazole；2-[3-(1-methyltetrazol-5-yl)sulfanylpropyl]isoindole-1,3-dione
• CAS: 80085-95-6
• 化学式: C₁₃H₁₃N₅O₂S
• 分子量: 303.345
• InChiKey: ZMCWRWQBTOKHIY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.4
• 重原子数：
  21
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.31
• 拓扑面积：
  106
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  2-(3-(1-methyltetrazol-5-ylthio)propyl)-1H-isoindole-1,3(2H)-dione 在 一水合肼 作用下， 以 乙醇 、 乙酸乙酯 为溶剂， 生成 1-Methyl-5-(3-aminopropylthio)-1,2,3,4-tetrazole
  参考文献：
  名称：

  Tetrazole derivatives, and anti-ulcer composition containing the same

  摘要：

  Tetrazole衍生物的化学式为：##STR1## 其中R.sup.1是较低的烷基、苯基或化学式的基团：--S(O).sub.l --A--(X).sub.m --R.sup.3，而R.sup.2是氢、较低的烷基、苯基或环烷基，当R.sup.1是基团--S(O).sub.l --A--(X).sub.m --R.sup.3时，或者R.sup.2是化学式的基团：--B--CO--R.sup.4，当R.sup.1是较低的烷基或苯基时，以及其药学上可接受的盐，具有预防或治疗胃溃疡和/或十二指肠溃疡的活性，并可用作抗溃疡药物；制备Tetrazole衍生物的方法；以及含有上述Tetrazole衍生物的药物组合物。

  公开号：

  US04372953A1
• 作为产物：
  描述：

  N-(3-溴丙基)苯二胺 、 1-甲基-5-巯基-1H-四氮唑 在 potassium carbonate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 6.0h， 以88%的产率得到2-(3-(1-methyltetrazol-5-ylthio)propyl)-1H-isoindole-1,3(2H)-dione
  参考文献：
  名称：

  Synthesis and antibacterial activity of novel ketolides with 11,12-sulfur contained aryl alkyl side chains

  摘要：

  A novel series of ketolides with 11,12-sulfur contained aryl alkyl side chains were synthesized and evaluated for their antibacterial activity. These ketolides exhibited potent activity against key macrolide sensitive and resistant respiratory pathogens. The newly synthesized 9a, 9e, 9k and 9n showed a similar antimicrobial spectrum and comparable activity to telithromycin, the commercial ketolide antibacterial. (C) 2010 Elsevier Masson SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2010.11.004

文献信息

• Tetrazole derivatives, and anti-ulcer composition containing the same
  申请人：Otsuka Pharmaceutical Company, Limited

  公开号：US04372953A1

  公开（公告）日：1983-02-08

  Tetrazole derivatives of the formula: ##STR1## wherein R.sup.1 is a lower alkykl, phenyl or a group of the formula: --S(O).sub.l --A--(X).sub.m --R.sup.3, and R.sup.2 is hydrogen, a lower alkyl, phenyl or a cycloalkyl when R.sup.1 is the group --S(O).sub.l --A--(X).sub.m --R.sup.3, or R.sup.2 is a group of the formula: --B--CO--R.sup.4 when R.sup.1 is a lower alkyl or phenyl and a pharmaceutically acceptable salt thereof, which have prophylactic or therapeutic activities against peptic and/or duodenal ulcers and are useful as an anti-ulcer drug; processes for the preparation of the tetrazole derivatives; and pharmaceutical composition containing said tetrazole derivatives.

  Tetrazole衍生物的化学式为：##STR1## 其中R.sup.1是较低的烷基、苯基或化学式的基团：--S(O).sub.l --A--(X).sub.m --R.sup.3，而R.sup.2是氢、较低的烷基、苯基或环烷基，当R.sup.1是基团--S(O).sub.l --A--(X).sub.m --R.sup.3时，或者R.sup.2是化学式的基团：--B--CO--R.sup.4，当R.sup.1是较低的烷基或苯基时，以及其药学上可接受的盐，具有预防或治疗胃溃疡和/或十二指肠溃疡的活性，并可用作抗溃疡药物；制备Tetrazole衍生物的方法；以及含有上述Tetrazole衍生物的药物组合物。
• Tetrazole derivatives, process for the preparation thereof, and anti-ulcer composition containing the same
  申请人：OTSUKA PHARMACEUTICAL CO., LTD.

  公开号：EP0035228A1

  公开（公告）日：1981-09-09

  Tetrazole derivatives of the formula: wherein R1 is a lower alkyl, phenyl or a group of the formula: -S(O)ℓ-A-(X)m-R3, and R2 is hydrogen, a lower alkyl, phenyl or a cycloalkyl when R' is the group-S(O)ℓ-A-(X)m--R3, or R2 is a group of the formula: -B-CO-R4 when R1 is a lower alkyl or phenyl and a pharmaceutically acceptable salt thereof, which have prophylactic or therapeutic activities against peptic and/or duodenal ulcers and are useful as an anti-ulcer drug; processes for the preparation of the tetrazole derivatives; and pharmaceutical composition containing said tetrazole derivatives.

  式中的四唑衍生物： 其中 R1 是低级烷基、苯基或式中的基团：-R2是氢、低级烷基、苯基或环烷基，当R'是式中的基团-S(O)ℓ-A-(X)m--R3，或R2是式中的基团：-B-CO-R4（当 R1 为低级烷基或苯基时）及其药学上可接受的盐，对消化性溃疡和/或十二指肠溃疡具有预防或治疗活性，可用作抗溃疡药物；四唑衍生物的制备工艺；以及含有上述四唑衍生物的药物组合物。
• US4372953A
  申请人：——

  公开号：US4372953A

  公开（公告）日：1983-02-08
• Synthesis and antibacterial activity of novel ketolides with 11,12-sulfur contained aryl alkyl side chains
  作者：Xiao-zhuo Chen、Peng Xu、Lu Liu、Dan Zheng、Ping-sheng Lei

  DOI：10.1016/j.ejmech.2010.11.004

  日期：2011.1

  A novel series of ketolides with 11,12-sulfur contained aryl alkyl side chains were synthesized and evaluated for their antibacterial activity. These ketolides exhibited potent activity against key macrolide sensitive and resistant respiratory pathogens. The newly synthesized 9a, 9e, 9k and 9n showed a similar antimicrobial spectrum and comparable activity to telithromycin, the commercial ketolide antibacterial. (C) 2010 Elsevier Masson SAS. All rights reserved.