1-phenyl-1-(3-trifluoromethanesulfonamidophenyl)-ethylene | 55251-20-2

• 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: 1-phenyl-1-(3-trifluoromethanesulfonamidophenyl)-ethylene
• 英文别名: 1,1,1-Trifluoro-N-[3-(1-phenylethenyl)phenyl]methanesulfonamide
• CAS: 55251-20-2
• 化学式: C₁₅H₁₂F₃NO₂S
• 分子量: 327.327
• InChiKey: FTRFYAXVXRZNTH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.3
• 重原子数：
  22
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  54.6
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  3-(1-Phenyl-1-hydroxyaethyl)trifluoromethanesulfonanilid 在 硫酸 作用下， 以 溶剂黄146 为溶剂， 生成 1-phenyl-1-(3-trifluoromethanesulfonamidophenyl)-ethylene
  参考文献：
  名称：

  Antiinflammatory fluoroalkanesulfonanilides. 3. Other fluoroalkanesulfonamido diaryl systems

  摘要：

  A series of isosteres of 3-benzoyltrifluoromethanesulfonanilide involving alternatives to the carbonyl linking group was synthesized and screened for antiinflammatory activity in the carrageenan rat paw edema test. The systems examined were of the type m-CF3SO2NH-C6H4-X-C6H5, where X was -CROH-, -CHR-, -CH(OH)CH2-, -COCH2-, -CH2CO-, greater than C equal to CR2, -CR equal to CH, -C identical to C-, -CH2CH2-, CONH-, -NR-, -O-, -S(O)n- (n equal to 0,1,2), and carbon-carbon single bond. Many ortho and para derivatives were also tested. Several of these new trifluoromethanesulfonanilides proved equipotent with phenylbutazone. The effects on the anticarrageenan activity of both the nature and ring position of X are discussed.

  DOI：

  10.1021/jm00238a013

文献信息

• US3972926A
  申请人：——

  公开号：US3972926A

  公开（公告）日：1976-08-03
• Antiinflammatory fluoroalkanesulfonanilides. 3. Other fluoroalkanesulfonamido diaryl systems
  作者：G. G. I. Moore、J. K. Harrington、K. F. Swingle

  DOI：10.1021/jm00238a013

  日期：1975.4

  A series of isosteres of 3-benzoyltrifluoromethanesulfonanilide involving alternatives to the carbonyl linking group was synthesized and screened for antiinflammatory activity in the carrageenan rat paw edema test. The systems examined were of the type m-CF3SO2NH-C6H4-X-C6H5, where X was -CROH-, -CHR-, -CH(OH)CH2-, -COCH2-, -CH2CO-, greater than C equal to CR2, -CR equal to CH, -C identical to C-, -CH2CH2-, CONH-, -NR-, -O-, -S(O)n- (n equal to 0,1,2), and carbon-carbon single bond. Many ortho and para derivatives were also tested. Several of these new trifluoromethanesulfonanilides proved equipotent with phenylbutazone. The effects on the anticarrageenan activity of both the nature and ring position of X are discussed.