6-methoxy-3-(1-methylethoxy)benzothiophene-2-carboxylate | 104795-58-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并噻吩类
• 英文名称: 6-methoxy-3-(1-methylethoxy)benzothiophene-2-carboxylate
• 英文别名: 6-Methoxy-3-(1-methylethoxy)-benzo[b]thiophene-2-carboxylic acid；Benzo[b]thiophene-2-carboxylic acid, 6-methoxy-3-(1-methylethoxy)-；6-Methoxy-3-(1-methylethoxy)benzo[b]thiophene-2-carboxylic acid；6-methoxy-3-propan-2-yloxy-1-benzothiophene-2-carboxylic acid
• CAS: 104795-58-6
• 化学式: C₁₃H₁₄O₄S
• 分子量: 266.318
• InChiKey: XSOSNGFZPLAZCB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.5
• 重原子数：
  18
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.31
• 拓扑面积：
  84
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  6-methoxy-3-(1-methylethoxy)benzothiophene-2-carboxylate 生成 6-methoxy-3-(1-methylethoxy)-N-1H-tetrazol-5-yl-benzo[b]thiophene-2-carboxamide
  参考文献：
  名称：

  CONNOR, DAVID T.;MULLICAN, MICHAEL D.;SORENSON, RODERICK J.;THUESON, DAVI+

  摘要：

  DOI：
• 作为产物：
  描述：

  3-氯-6-甲氧基苯并[b]噻吩-2-甲酰氯 在 sodium hydroxide 作用下， 以 四氢呋喃 、 甲醇 、 水 、 异丙醇 、 mineral oil 为溶剂， 生成 6-methoxy-3-(1-methylethoxy)benzothiophene-2-carboxylate
  参考文献：
  名称：

  Benzofurans and benzothiophenes having antiallergic activity and method

  摘要：

  具有抗过敏活性的新型苯并噻吩，以及用于治疗急性呼吸窘迫综合征的新型和其他选择的苯并噻吩。本发明的苯并噻吩特别是苯并噻吩的2-四唑基甲酰胺。

  公开号：

  US04910317A1

文献信息

• Method for treating acute respirator distress syndrome
  申请人：Warner-Lambert Company

  公开号：US04931459A1

  公开（公告）日：1990-06-05

  Novel benzothiophenes having antiallergic activity and both novel and other selected benzothiophenes having activity for treating acute respiratory distress syndrome. The benzothiophenes of the present invention are particularly 2-tetrazolylcarboxamides of the benzothiophenes.

  具有抗过敏活性的新型苯并噻吩和具有治疗急性呼吸窘迫综合症活性的新型和其他选择的苯并噻吩。本发明的苯并噻吩特别是苯并噻吩的2-四唑基甲酰胺。
• Novel benzothiophenes having antiallergic activity and both novel and other selected benzothiophenes having activity for treating acute respiratory distress syndrome
  申请人：WARNER-LAMBERT COMPANY

  公开号：EP0299457A2

  公开（公告）日：1989-01-18

  Novel benzothiophenes having antiallergic activity and both novel and other selected benzo­thiophenes having activity for treating acute respiratory distress syndrome. The benzothiophenes of the present invention are particularly 2-tetrazolyl­carboxamides of the benzothiophenes.

  具有抗过敏活性的新型苯并噻吩，以及具有治疗急性呼吸窘迫综合征活性的新型苯并噻吩和其他精选苯并噻吩。本发明的苯并噻吩尤其是苯并噻吩的 2-四唑甲酰胺。
• Novel benzothiophene-, benzofuran-, and naphthalenecarboxamidotetrazoles as potential antiallergy agents
  作者：David T. Connor、Wiaczeslaw A. Cetenko、Michael D. Mullican、Roderick J. Sorenson、Paul C. Unangst、Robert J. Weikert、Richard L. Adolphson、John A. Kennedy、David O. Thueson

  DOI：10.1021/jm00083a023

  日期：1992.3

  The synthesis and antiallergic activity of a series of novel benzothiophene-, benzofuran-, and naphthalenecarbox-amidotetrazoles are described. A number of the compounds inhibit the release of histamine from anti-IgE stimulated basophils obtained from allergic donors. Optimal inhibition is exhibited in benzothiophenes with a 3-alkoxy substituent in combination with a 5-methoxy, 6-methoxy, or a 5,6-dimethoxy group. Compounds 13c (CI-959) also inhibited respiratory burst of human neutrophils and the release of mediators from anti-IgE-stimulated human chopped lung.
• CONNOR, DAVID T.;CETENKO, WIACZESLAW A.;UNANGST, PAUL C.;JOHNSON, ELIZABE+
  作者：CONNOR, DAVID T.、CETENKO, WIACZESLAW A.、UNANGST, PAUL C.、JOHNSON, ELIZABE+

  DOI：——

  日期：——
• US4910317A
  申请人：——

  公开号：US4910317A

  公开（公告）日：1990-03-20