吖啶-4,5-二胺 | 3407-96-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 中文名称: 吖啶-4,5-二胺
• 英文名称: 4,5-Diamino-acridin
• 英文别名: 4,5-Acridinediamine；acridine-4,5-diamine
• CAS: 3407-96-3
• 化学式: C₁₃H₁₁N₃
• 分子量: 209.25
• InChiKey: URHUZZRZASOLKY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.6
• 重原子数：
  16
• 可旋转键数：
  0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  64.9
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  吖啶-4,5-二胺 、 2-ethylthio-6-(1-octylnonadecyl)-4(3H)-pyrimidone 反应 15.0h， 以10%的产率得到2-<5-(4-amino)-acridinylamino>-6-(1-octylnonadecyl)-4(3H)-pyrimidone
  参考文献：
  名称：

  Neutral hosts for the complexation of creatinine

  摘要：

  Three hydrogen bonds are formed between creatinine and derivatives of 2-amino-4(3H)pyrimidone. Changes in the tautomer ratio of the latter upon complexation can be observed by UV spectroscopy. The formation of a further hydrogen bond between creatinine and a 4-aminoacridin-5-yl-amino-substituted 4(3H)pyrimidone seems to be sterically prevented. The properties of three other, quite different compounds assumed to form three hydrogen bonds with creatinine have also been investigated. Dodecyl 4-octadecylallophanate and 2,6-bis(dodecylamino)-pyridine do not associate appreciably with creatinine, which can be explained by the formation of an intramolecular hydrogen bond in the former compound and the lack of tautomerization of the latter. With 6-(1-heptyloctylamino)-2(1H)-pyridone, however, creatinine forms a complex that is almost as stable as those with 2-amino-4(3H)-pyrimidone derivatives.

  DOI：

  10.1016/s0040-4020(01)87238-0
• 作为产物：
  描述：

  4,5-diamino-9(10H)-acridinone 在 sodium amalgam 、 水 作用下， 反应 2.0h， 以65%的产率得到吖啶-4,5-二胺
  参考文献：
  名称：

  SYNTHESIS OF 1,9-DIAMIDINIUMACRIDINE AS A POTENTIAL RECEPTOR FOR PHOSPHATE ESTER RECOGNITION

  摘要：

  DOI：

  10.1080/00304940009355954

文献信息

• Goldberg; Kelly, Journal of the Chemical Society, <1947> 595
  作者：Goldberg、Kelly

  DOI：——

  日期：——
• Klein; Lahey, Journal of the Chemical Society, <1947> 1418
  作者：Klein、Lahey

  DOI：——

  日期：——
• Neutral hosts for the complexation of creatinine
  作者：Philippe Bühlmann、Wilhelm Simon

  DOI：10.1016/s0040-4020(01)87238-0

  日期：1993.8

  Three hydrogen bonds are formed between creatinine and derivatives of 2-amino-4(3H)pyrimidone. Changes in the tautomer ratio of the latter upon complexation can be observed by UV spectroscopy. The formation of a further hydrogen bond between creatinine and a 4-aminoacridin-5-yl-amino-substituted 4(3H)pyrimidone seems to be sterically prevented. The properties of three other, quite different compounds assumed to form three hydrogen bonds with creatinine have also been investigated. Dodecyl 4-octadecylallophanate and 2,6-bis(dodecylamino)-pyridine do not associate appreciably with creatinine, which can be explained by the formation of an intramolecular hydrogen bond in the former compound and the lack of tautomerization of the latter. With 6-(1-heptyloctylamino)-2(1H)-pyridone, however, creatinine forms a complex that is almost as stable as those with 2-amino-4(3H)-pyrimidone derivatives.
• SYNTHESIS OF 1,9-DIAMIDINIUMACRIDINE AS A POTENTIAL RECEPTOR FOR PHOSPHATE ESTER RECOGNITION
  作者：R. P. Dixon、J. S. Snyder、L. Bradley、J. Linnenbrink

  DOI：10.1080/00304940009355954

  日期：2000.12