2,4-dichloro-6-(3,4-dichloroanilino)-s-triazine | 18996-86-6

• 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: 2,4-dichloro-6-(3,4-dichloroanilino)-s-triazine
• 英文别名: 4,6-dichloro-N-(3,4-dichlorophenyl)-1,3,5-triazin-2-amine
• CAS: 18996-86-6
• 化学式: C₉H₄Cl₄N₄
• 分子量: 309.97
• InChiKey: SSKNZKJXTPZMJL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5
• 重原子数：
  17
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  50.7
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  2,4-dichloro-6-(3,4-dichloroanilino)-s-triazine 在 盐酸 、 碳酸氢钠 作用下， 以 四氢呋喃 、 1,4-二氧六环 、 甲醇 为溶剂， 生成 (3S,5R)-1-[4-[(3S,5R)-3,5-diaminopiperidin-1-yl]-6-(3,4-dichloroanilino)-1,3,5-triazin-2-yl]piperidine-3,5-diamine
  参考文献：
  名称：

  Structure–activity relationships of novel antibacterial translation inhibitors: 3,5-Diamino-piperidinyl triazines

  摘要：

  Structure-activity relationships of the 3,5-diamino-piperidinyl triazine series, a novel class of bacterial translation inhibitors, are described. Optimization was focused on the triazine C-4 position in which aromatic substituents that contained electron-withdrawing groups led to potent inhibitors. The initial lack of antibacterial activity was correlated with poor cellular penetration. Whole cell antibacterial activity was achieved by linking additional aromatic moieties at the triazine C-4 position. (c) 2006 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2006.07.052
• 作为产物：
  描述：

  三聚氯氰 、 3,4-二氯苯胺 在 碳酸氢钠 作用下， 以 四氢呋喃 为溶剂， 反应 0.67h， 生成 2,4-dichloro-6-(3,4-dichloroanilino)-s-triazine
  参考文献：
  名称：

  Structure–activity relationships of novel antibacterial translation inhibitors: 3,5-Diamino-piperidinyl triazines

  摘要：

  Structure-activity relationships of the 3,5-diamino-piperidinyl triazine series, a novel class of bacterial translation inhibitors, are described. Optimization was focused on the triazine C-4 position in which aromatic substituents that contained electron-withdrawing groups led to potent inhibitors. The initial lack of antibacterial activity was correlated with poor cellular penetration. Whole cell antibacterial activity was achieved by linking additional aromatic moieties at the triazine C-4 position. (c) 2006 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2006.07.052

文献信息

• DEFAUNATION METHOD
  申请人：MALLINCKRODT VETERINARY LIMITED

  公开号：EP0661976A1

  公开（公告）日：1995-07-12
• EP0661976A4
  申请人：——

  公开号：EP0661976A4

  公开（公告）日：1994-07-20
• US5561131A
  申请人：——

  公开号：US5561131A

  公开（公告）日：1996-10-01
• [EN] DEFAUNATION METHOD
  申请人：PITMAN-MOORE AUSTRALIA LIMITED

  公开号：WO1993002680A1

  公开（公告）日：1993-02-18

  (EN) The use of triazine compounds of formula (I) for the preparation of a medicament for use in a method for defaunation of ruminant animals, in which an effective amount of the compound is administered to the animals. Defaunation is the selective removal of protozoa from the rumen in preference to removal or deactivation of bacteria. In formula (I): x = 1 or 2, R = H or lower alkyl, Ar = phenyl, diphenyl, naphthyl, anthracyl or phenanthryl radicals and substituted derivatives thereof.(FR) Utilisation de composés de triazine de la formule (I) pour la préparation d'un médicament utilisé dans un procédé de défaunation de ruminants, selon lequel une quantité efficace du composé est administrée aux animaux. La défaunation consiste à enlever de préférence sélectivement des protozoaires de la panse au lieu d'enlever ou de désactiver des bactéries. Dans la formule (I) x = 1 ou 2, R = H ou alkyle inférieur, Ar = radicaux de phényle, diphényle, naphtyle, anthracyle ou phénanthryle et dérivés substitués de ces radicaux.
• Structure–activity relationships of novel antibacterial translation inhibitors: 3,5-Diamino-piperidinyl triazines
  作者：Yuefen Zhou、Zhongxiang Sun、Jamie M. Froelich、Thomas Hermann、Daniel Wall

  DOI：10.1016/j.bmcl.2006.07.052

  日期：2006.10

  Structure-activity relationships of the 3,5-diamino-piperidinyl triazine series, a novel class of bacterial translation inhibitors, are described. Optimization was focused on the triazine C-4 position in which aromatic substituents that contained electron-withdrawing groups led to potent inhibitors. The initial lack of antibacterial activity was correlated with poor cellular penetration. Whole cell antibacterial activity was achieved by linking additional aromatic moieties at the triazine C-4 position. (c) 2006 Elsevier Ltd. All rights reserved.