6-吗啉-4-基-1,3,5-三嗪-2,4-二胺 | 2827-42-1

• 分子结构分类: 有机化合物 - 有机氮化合物
• 中文名称: 6-吗啉-4-基-1,3,5-三嗪-2,4-二胺
• 英文名称: 2-morpholino-4,6-diamino-1,3,5-triazine
• 英文别名: 6-morpholino-[1,3,5]-triazine-2,4-diamine；2,4-diamino-6-morpholino-1,3,5-triazine；6-morpholin-4-yl-[1,3,5]triazine-2,4-diamine；6-Morpholino-[1,3,5]triazin-2,4-diyldiamin；2-Morpholino-4,6-diamino-s-triazin；s-Triazine, 2,4-diamino-6-morpholino-；6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
• CAS: 2827-42-1
• 化学式: C₇H₁₂N₆O
• 分子量: 196.212
• InChiKey: SDSUSOOLEPDQPJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.6
• 重原子数：
  14
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  103
• 氢给体数：
  2
• 氢受体数：
  7

安全信息

• 海关编码：
  2934999090

反应信息

• 作为反应物：
  描述：

  6-吗啉-4-基-1,3,5-三嗪-2,4-二胺 、 异氰酸苯酯 以 neat (no solvent) 为溶剂， 反应 0.83h， 以85%的产率得到1-(4-amino-6-morpholino-[1,3,5]-triazin-2-yl)-3-phenylurea
  参考文献：
  名称：

  Microwave-assisted selective and efficient synthesis of 1,3,5-triazinyl mono and bisureas

  摘要：

  An efficient and sustainable microwave-assisted approach for the one-step preparation of a wide range of 1,3,5-triazinyl mono- and bisureas has been developed, combining solvent-free conditions and microwave irradiation. In these conditions the very unreactive amino groups of 1,3,5-triazine-2,4-diamines successfully react with phenylisocyanate to yield selectively mono and bisureas.This protocol resulted in the shortest reaction times reported so far and is generally applicable for the preparation of these valuable heterocyclic systems. (C) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2014.01.043
• 作为产物：
  描述：

  吗啉 以 甲苯 为溶剂， 生成 6-吗啉-4-基-1,3,5-三嗪-2,4-二胺
  参考文献：
  名称：

  Salts of triazine compounds with cyanuric acid as flame retardants

  摘要：

  三嗪类化合物与三聚氰酸的盐，通式为(I)：通过使用三聚氰酸与2,4,6-三氨基-1,3,5-三嗪衍生物进行盐化反应而获得。新的通式(I)盐特别用作阻燃添加剂。

  公开号：

  EP0550084A1

文献信息

• [EN] TRICYCLIC 2,4-DIAMIN0-L,3,5-TRIAZINE DERIVATIVES USEFUL FOR THE TREATMENT OF CANCER AND MYELOPROLIFERATIVE DISORDERS<br/>[FR] DÉRIVÉS TRICYCLIQUES DE 2,4-DIAMINO-L,3,5-TRIAZINE UTILES POUR LE TRAITEMENT DU CANCER ET DE TROUBLES MYÉLOPROLIFÉRATIFS
  申请人：ASTRAZENECA AB

  公开号：WO2009150462A1

  公开（公告）日：2009-12-17

  The present invention relates to compounds of Formula (I): (I) and to their salts, pharmaceutical compositions, methods of use, and methods for their preparation. These compounds provide a treatment for myeloproliferative disorders and cancer.

  本发明涉及公式（I）的化合物及其盐、药物组合物、使用方法和制备方法。这些化合物可用于治疗骨髓增生性疾病和癌症。
• Green synthesis and self-association of 2,4-diamino-1,3,5-triazine derivatives
  作者：Ángel Díaz-Ortiz、José Elguero、Concepción Foces-Foces、Antonio de la Hoz、Andrés Moreno、María del Carmen Mateo、Ana Sánchez-Migallón、Gema Valiente

  DOI：10.1039/b315956f

  日期：——

  2,4-Diamino-1,3,5-triazines have been prepared by reaction of dicyandiamide with nitriles under microwave irradiation, a method that can be considered as a green procedure due to the reduction in the use of solvents during synthesis and purification, the short reaction time and the simplicity of the procedure. The structures have been confirmed in solution by NMR spectroscopy. Variable temperature experiments have been used to calculate the free energy of activation for rotation about the amino–triazine bond. The crystal structures of three 2,4-diamino-6-R-1,3,5-triazine derivatives (3a: R = phenyl, 3i: R = 1-piperidino and 3g: R = 1-phenylpyrazol-3-yl) have been determined by X-ray analysis. The N–H⋯N interactions change from structure to structure, resulting in a variation from pseudo-honeycomb networks to corrugated rosette layers.

  2,4-二氨基-1,3,5-三嗪是通过在微波照射下将二氰胺与腈类反应制备的，这种方法可以被视为一种绿色程序，因为在合成和纯化过程中减少了溶剂的使用，反应时间短且过程简单。通过NMR光谱在溶液中确认了其结构。可变温度实验用于计算关于氨基-三嗪键旋转的活化自由能。三种2,4-二氨基-6-R-1,3,5-三嗪衍生物（3a: R=苯基, 3i: R=1-哌啶基和3g: R=1-苯基吡唑-3-基）的晶体结构已通过X射线分析确定。N–H⋯N相互作用因结构的不同而变化，导致从伪蜂窝网络到波纹玫瑰层的变化。
• Salts of triazinic compounds with oxygenated acids of phosphorus
  申请人：Ministero Dell' Universita' E Della Ricerca Scientifica E Tecnologica

  公开号：US05182388A1

  公开（公告）日：1993-01-26

  Salts of triazinic compounds with oxygenated acids of phosphorus, of the eral formula (I): ##STR1## wherein: at least one of radicals for R to R.sub.5 is: ##STR2## being: m=an integer comprised between 2 and 8; p=an integer comprised between 2 and 6; The new salts having the general formula (I) are applied, in particular, as anti-flame additives for polymers.

  三嗪化合物的含氧磷酸盐，其化学式为（I）：##STR1## 其中：R到R.sub.5中至少一个基团是：##STR2## 其中：m=2到8之间的整数；p=2到6之间的整数； 具有通式（I）的新盐特别适用于聚合物的阻燃添加剂。
• Salts of triazine compounds with cyanuric acid
  申请人：Ministero Dell'Universita' e Della Ricerca Scientifica

  公开号：US05371218A1

  公开（公告）日：1994-12-06

  Salts of triazine compounds with cyanuric acid, of general formula (I): ##STR1## obtained by salifying 2,4,6-triamino-1,3,5-triazine derivatives with cyanuric acid. The new salts of general formula (I) are used in particular as flame retardant additives.

  三嗪衍生物与三聚氰酸盐的盐，通式为（I）：##STR1## 通过将2,4,6-三氨基-1,3,5-三嗪衍生物与三聚氰酸盐化而得。新的通式（I）的盐主要用作阻燃添加剂。
• Self-extinguishing polymeric compositions
  申请人：MINISTERO DELL' UNIVERSITA' E DELLA RICERCA SCIENTIFICA E TECNOLOGICA

  公开号：EP0451807A2

  公开（公告）日：1991-10-16

  Described are self-extinguishing polymeric compositions comprising: a) from 90 to 40 parts by weight of thermoplastic polymer, or of polymer having elastomeric properties; b) from 10 to 60 parts by weight of one or more derivatives of 2,4,6-triamino-1,3,5-triazine which derivatives are salified and have the general formula (I): wherein the radicals R and R₁ to R₅ are as defined in claim 1. Optionally, said polymeric compositions may also comprise minor quantities of ammonium phosphates and/or amine phosphates.

  所述自熄灭聚合物组合物包括 a) 90 至 40 份（按重量计）热塑性聚合物或具有弹性特性的聚合物； b) 10 至 60 份（按重量计）2,4,6-三氨基-1,3,5-三嗪的一种或多种衍生物，这些衍生物经过盐析，具有通式 (I)： 其中 基 R 和 R₁ 至 R₅ 如权利要求 1 所定义。 可选地，所述聚合物组合物还可包含少量磷化铵和/或磷化胺。