2-(1-naphthylmethyl)-1-(2,4-dihydroxythiobenzoyl)-2-imidazoline

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 2-(1-naphthylmethyl)-1-(2,4-dihydroxythiobenzoyl)-2-imidazoline
• 英文别名: (2,4-Dihydroxyphenyl)-[2-(1-naphthylmethyl)-4,5-dihydroimidazol-1-yl]methanethione；(2,4-dihydroxyphenyl)-[2-(naphthalen-1-ylmethyl)-4,5-dihydroimidazol-1-yl]methanethione
• 化学式: C₂₁H₁₈N₂O₂S
• 分子量: 362.452
• InChiKey: NMMBGXHFMPSZQA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  26
• 可旋转键数：
  3
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  88.2
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  4,5-二氢-2-(1-萘基甲基)-1H-咪唑鎓硝酸盐 、 bis-(2,4-dihydroxythiobenzoyl)sulfinyl 在 吡啶 作用下， 以 甲醇 为溶剂， 反应 10.0h， 生成 2-(1-naphthylmethyl)-1-(2,4-dihydroxythiobenzoyl)-2-imidazoline
  参考文献：
  名称：

  Synthesis of some 1-(2,4-dihydroxythiobenzoyl)imidazoles, -imidazolines and -tetrazoles and their potent activity against Candida species

  摘要：

  Various 1-(2,4-dihydroxythiobenzoyl)imidazoles, -imidazolines and -tetrazoles were synthesized and evaluated for their in vitro antifungal activity. Compounds were prepared by the reaction of sulfinyl-bis-(2,4-dihydroxythiobenzoyl) with properly substituted azoles. The MIC values against the Candida albicans ATCC 10231 strain, the azole-resistant clinical isolates of C. albicans and non-Candida species were determined. Tetrazole derivatives were the most active against C. albicans, imidazoline derivatives against non-Candida species. All compounds showed higher activity than that of comparable drugs.

  DOI：

  10.1016/s0014-827x(03)00046-6

文献信息

• Synthesis of some 1-(2,4-dihydroxythiobenzoyl)imidazoles, -imidazolines and -tetrazoles and their potent activity against Candida species
  作者：Joanna Matysiak、Andrzej Niewiadomy、Elżbieta Krajewska-Kułak、Grażyna Mącik-Niewiadomy

  DOI：10.1016/s0014-827x(03)00046-6

  日期：2003.6

  Various 1-(2,4-dihydroxythiobenzoyl)imidazoles, -imidazolines and -tetrazoles were synthesized and evaluated for their in vitro antifungal activity. Compounds were prepared by the reaction of sulfinyl-bis-(2,4-dihydroxythiobenzoyl) with properly substituted azoles. The MIC values against the Candida albicans ATCC 10231 strain, the azole-resistant clinical isolates of C. albicans and non-Candida species were determined. Tetrazole derivatives were the most active against C. albicans, imidazoline derivatives against non-Candida species. All compounds showed higher activity than that of comparable drugs.