acetonyl 3,4-dichlorophenyl sulfide | 19968-29-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: acetonyl 3,4-dichlorophenyl sulfide
• 英文别名: 1-(3,4-dichloro-phenylsulfanyl)-propan-2-one；1-[(3,4-Dichlorophenyl)sulfanyl]propan-2-one；1-(3,4-dichlorophenyl)sulfanylpropan-2-one
• CAS: 19968-29-7
• 化学式: C₉H₈Cl₂OS
• 分子量: 235.134
• InChiKey: BHVWEEGHKILTTJ-UHFFFAOYSA-N

物化性质

• 沸点：
  170-180 °C(Press: 20-25 Torr)
• 密度：
  1.36±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.7
• 重原子数：
  13
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.22
• 拓扑面积：
  42.4
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  acetonyl 3,4-dichlorophenyl sulfide 在 氨 、 间氯过氧苯甲酸 作用下， 以 甲醇 、 氯仿 为溶剂， 反应 17.0h， 生成 2-(3,4-Dichlorophenyl)sulfonyl-6,7-difluoro-3-methyl-4-oxidoquinoxalin-1-ium 1-oxide
  参考文献：
  名称：

  Synthesis, anti-mycobacterial, anti-trichomonas and anti-candida in vitro activities of 2-substituted-6,7-difluoro-3-methylquinoxaline 1,4-dioxides

  摘要：

  A new series of 23 6,7-difluoro-3-methyl-2-phenylthio/phenylsulfonyl/phenylsulfinyl/benzylamino/phenylamino-quinoxaline 1,4-dioxides variously substituted in the phenyl moiety, was synthesized and submitted to in vitro evaluation for anti-mycobacterial, anti-trichomonas, anti-candida, anti-mycoplasma and antibacterial activities. In anti-mycobacterial assays, several compounds resulted active (MIC90 = 2.0-4.0 mug/ml) against Mycobacterium tuberculosis H37Rv. Anti-trichomonas screening showed a generally good activity of all compounds (MBC = 0.39-25.0 mug/ml) versus Trichomonas vaginalis, in particular the derivatives 5a,d, 7a, 9 and 11c ranged 0.39-0.78 mug/ml (metronidazole MBC = 12.5 mug/ml). Results of anti-candida assays showed that derivatives 7a, 8a,d and 9 were active against several species of Candida (C. albicans, C. krusei, C. parapsilosis and C. glabrata), having MIC50 between 3.9 and 31.25 mug/ml. The latter compounds were also submitted to anti-mycoplasma assay against Mycoplasma hominis. the results obtained showed that 7a, 8a,d and 9 inhibited the growth of the mycoplasma at the concentration of 0.1 mg/ml. In antibacterial tests only a few compounds showed an MIC50 lower than 62.5 mug/ml against representative strains of Gram-positive and Gram-negative bacteria (Escherichia coli, Klebsiella pneumoniae, Staphylococcus aureus, Vibrio alginolyticus and Pseudomonas aeruginosa). (C) 2003 Elsevier SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2003.11.008
• 作为产物：
  描述：

  3,4-二氯苯硫酚 、 一氯丙酮 在 吡啶 作用下， 生成 acetonyl 3,4-dichlorophenyl sulfide
  参考文献：
  名称：

  Menon,N.K.; Nargund,K.S., Indian Journal of Chemistry, 1967, vol. 5, p. 478 - 479

  摘要：

  DOI：

文献信息

• 1-Phenylthio-2-aminopropane derivatives, their production and use
  申请人：Takeda Chemical Industries, Ltd.

  公开号：EP0053015A1

  公开（公告）日：1982-06-02

  Novel 1-phenylthio-2-aminopropane derivatives, inclusive of salts thereof, of the formula: wherein R1 is halogen, R2 is hydrogen or halogen and R3 is methyl, ethyl or hydroxyethyl, have antiobesity and antidiabetic actions.

  新颖的 1-苯硫基-2-氨基丙烷衍生物（包括其盐类）具有抗肥胖和抗糖尿病作用： 其中 R1 为卤素，R2 为氢或卤素，R3 为甲基、乙基或羟乙基，具有抗肥胖和抗糖尿病作用。
• MEGURO, KANJI;TAWADA, HIROYUKI;KUBO, KEIJI;IKEDA, HITOSHI;MATSUO, TAKAO, J. TAKEDA RES. LAB., 1985, 44, N 3-4, 186-198
  作者：MEGURO, KANJI、TAWADA, HIROYUKI、KUBO, KEIJI、IKEDA, HITOSHI、MATSUO, TAKAO

  DOI：——

  日期：——
• PYRIDINOL DERIVATIVES AS MEDICAMENTS
  申请人：SMITHKLINE BEECHAM PLC

  公开号：EP0607217A1

  公开（公告）日：1994-07-27
• [EN] PYRIDINOL DERIVATIVES AS MEDICAMENTS
  申请人：SMITHKLINE BEECHAM PLC

  公开号：WO1993007137A1

  公开（公告）日：1993-04-15

  (EN) Trisubstituted pyridinol derivatives are described as agonists of a cyclic AMP-dependent protein kinase useful as medicaments.(FR) On décrit des dérivés de pyridinol trisubstitués agissant comme agonistes d'une protéine kinase dépendante de l'AMP cyclique et pouvant être utilisés comme médicaments.