hydrochloride of 2-piperazino-4-isopropylamino-5-methyl-6-chloropyrimidine | 84727-77-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪烷类
• 英文名称: hydrochloride of 2-piperazino-4-isopropylamino-5-methyl-6-chloropyrimidine
• 英文别名: 6-chloro-5-methyl-2-piperazin-1-yl-N-propan-2-ylpyrimidin-4-amine;hydrochloride
• CAS: 84727-77-5
• 化学式: C₁₂H₂₀ClN₅*ClH
• 分子量: 306.238
• InChiKey: YQTCIOVIEJINHJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.09
• 重原子数：
  19
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  53.1
• 氢给体数：
  3
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  4-(4-Chloro-6-isopropylamino-5-methyl-pyrimidin-2-yl)-piperazine-1-carbaldehyde 、 盐酸 生成 hydrochloride of 2-piperazino-4-isopropylamino-5-methyl-6-chloropyrimidine
  参考文献：
  名称：

  GUEREMY C.; AUDIAU F.; RENAULT CH.; BENAVIDES J.; UZAN A.; LE FUR G., J. MED. CHEM., 29,(1986) N 8, 1394-1398

  摘要：

  DOI：

文献信息

• Derivatives of 2-piperazino-pyrimidine, methods for their preparation
  申请人：Pharmuka Laboratoires

  公开号：US04535080A1

  公开（公告）日：1985-08-13

  Compounds are disclosed as useful as drugs or as intermediates for the manufacture of drugs, the compounds having the formula: ##STR1## in which X is hydrogen, chlorine, alkyl, alkoxy or alkylthio having 1 to 3 carbon atoms, R.sub.2 is hydrogen or alkyl having 1 to 3 carbon atoms, Y.sub.2 is chlorine and Y.sub.1 is chlorine or ##STR2## in which R.sub.1 is hydrogen, straight or branched chain alkyl having 1 to 7 carbon atoms, cycloalkyl having 3 to 7 carbon atoms or cycloalkylalkyl having 4 to 8 carbon atoms, or Y.sub.2 and Y.sub.1 are both OH. Also disclosed are methods for preparation of the compounds.

  化合物被披露为药物或制药中间体，该化合物具有以下结构式：其中X为氢、氯、含有1至3个碳原子的烷基、烷氧基或烷硫基，R.sub.2为氢或含有1至3个碳原子的烷基，Y.sub.2为氯，Y.sub.1为氯或其中R.sub.1为氢、直链或支链烷基，含有1至7个碳原子，环烷基，含有3至7个碳原子，或环烷基烷基，含有4至8个碳原子，或Y.sub.2和Y.sub.1均为OH。还披露了制备该化合物的方法。
• GUEREMY C.; AUDIAU F.; RENAULT CH.; BENAVIDES J.; UZAN A.; LE FUR G., J. MED. CHEM., 29,(1986) N 8, 1394-1398
  作者：GUEREMY C.、 AUDIAU F.、 RENAULT CH.、 BENAVIDES J.、 UZAN A.、 LE FUR G.

  DOI：——

  日期：——