[2-(4-Biphenylyl)-2-oxo-ethylthio]acetic acid methyl ester | 60992-38-3

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: [2-(4-Biphenylyl)-2-oxo-ethylthio]acetic acid methyl ester
• 英文别名: Methyl 2-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanylacetate
• CAS: 60992-38-3
• 化学式: C₁₇H₁₆O₃S
• 分子量: 300.378
• InChiKey: JKXNZMPGNFJGLC-UHFFFAOYSA-N

物化性质

• 沸点：
  450.7±35.0 °C(Predicted)
• 密度：
  1.186±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.8
• 重原子数：
  21
• 可旋转键数：
  7
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  68.7
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  [2-(4-Biphenylyl)-2-oxo-ethylthio]acetic acid methyl ester 在 双氧水 作用下， 以 溶剂黄146 为溶剂， 生成 [2-(4-Biphenylyl)-2-oxo-ethylsulfinyl]-acetic acid amide
  参考文献：
  名称：

  FR2271810

  摘要：

  公开号：
• 作为产物：
  描述：

  巯基乙酸甲酯 、 2-溴-4-苯基乙酰苯 在 三乙胺 作用下， 以 氯仿 为溶剂， 生成 [2-(4-Biphenylyl)-2-oxo-ethylthio]acetic acid methyl ester
  参考文献：
  名称：

  FR2271810

  摘要：

  公开号：

文献信息

• Biphenylyl derivatives
  申请人：Boehringer Ingelheim GmbH

  公开号：US03993683A1

  公开（公告）日：1976-11-23

  Compounds of the formula ##SPC1## Wherein R.sub.1 is hydrogen, fluorine, bromine, methyl, methoxy, methylthio, nitro, cyano or, when A is other than methylene, R.sub.2 is hydrogen, R.sub.3 is carboxyl, m is 2 and n is 0, also chlorine; R.sub.2 is hydrogen or fluorine; R.sub.3 is hydrogen, methyl, hydroxymethyl, carboxyl, (alkoxy of 1 to 6 carbon atoms)-carbonyl, methoxy-(alkoxy of 1 to 6 carbon atoms)-carbonyl, (alkenyloxy of 2 to 6 carbon atoms)-carbonyl, (aralkoxy of 7 to 12 carbon atoms)-carbonyl, phenoxy-carbonyl, pyridylmethoxy-carbonyl, amino-carbonyl, (alkyl of 1 to 3 carbon atoms-amino)-carbonyl, (dialkyl of 1 to 3 carbon atoms-amino)-carbonyl, phenylamino-carbonyl, morpholino-carbonyl, piperidino-carbonyl, thiomorpholino-carbonyl, (1-oxidothiomorpholino)-carbonyl or (1,1-dioxido-thiomorpholino)-carbonyl; A is methylene, (alkyl of 1 to 3 carbon atoms)-methylene, di-(alkyl of 1 to 3 carbon atoms)-methylene, hydroxymethyl-methylene, hydroxymethylene or carbonyl; m is 1 or 2; and n is 0, 1, 2 or 3; And, when R.sub.3 is carboxyl, non-toxic salts thereof formed with an inorganic or organic base. The compounds as well as the salts are useful as antithrombotics, anticholesteremics and anticoagulants.

  式为##SPC1##的化合物，其中R.sub.1为氢、氟、溴、甲基、甲氧基、甲硫基、硝基、氰基或当A不是亚甲基时，R.sub.2为氢，R.sub.3为羧基，m为2，n为0，还有氯；R.sub.2为氢或氟；R.sub.3为氢、甲基、羟甲基、羧基、（1至6个碳原子的烷氧基）-羰基、甲氧基-（1至6个碳原子的烷氧基）-羰基、（2至6个碳原子的烯氧基）-羰基、（7至12个碳原子的芳基氧基）-羰基、苯氧基-羰基、吡啶甲氧基-羰基、氨基-羰基、（1至3个碳原子的烷基氨基）-羰基、（1至3个碳原子的二烷基氨基）-羰基、苯基氨基-羰基、吗啉基-羰基、哌啶基-羰基、硫吗啉基-羰基、（1-氧代硫吗啉基）-羰基或（1,1-二氧代硫吗啉基）-羰基；A为亚甲基，（1至3个碳原子的烷基）-亚甲基，二（1至3个碳原子的烷基）-亚甲基，羟甲基-亚甲基，羟亚甲基或羰基；m为1或2；n为0、1、2或3；当R.sub.3为羧基时，与无机或有机碱形成的非毒性盐。这些化合物以及盐可用作抗血栓、抗胆固醇和抗凝剂。
• Synthesis, antimicrobial, and cytotoxicity studies of novel sulfur-linked quinoline–coumarin bisheterocycles
  作者：Nidhin Paul、Shanmugam Muthusubramanian

  DOI：10.1007/s00044-013-0761-7

  日期：2014.3

  A series of sulfur attached quinolines and quinoline-coumarin bisheterocycles have been synthesized by the Friedlander reaction of methyl 2-[(2,4-diaryl-3-quinolyl)sulfanyl]acetate and subsequent reaction with salicylaldehyde. These compounds were screened for their in vitro antimicrobial activity against Gram-positive, Gram-negative bacteria, and fungal pathogen. Among the 19 compounds screened, preliminary results indicated that many of the compounds demonstrated moderate to good antimicrobial activities. The cytotoxic effects against mouse fibroblasts (NIH 3T3) in vitro were evaluated for the most active compound, which displayed no toxic effects.
• US3993683A
  申请人：——

  公开号：US3993683A

  公开（公告）日：1976-11-23
• FR2271810
  申请人：——

  公开号：——

  公开（公告）日：——