N,N'-trimethylenebis(2-nitroaniline) | 21708-38-3

• 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: N,N'-trimethylenebis(2-nitroaniline)
• 英文别名: N,N'-bis(2-nitrophenyl)propane-1,3-diamine
• CAS: 21708-38-3
• 化学式: C₁₅H₁₆N₄O₄
• 分子量: 316.316
• InChiKey: FNVRIKYUKZEYSO-UHFFFAOYSA-N

物化性质

• 沸点：
  559.1±45.0 °C(Predicted)
• 密度：
  1.378±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.7
• 重原子数：
  23
• 可旋转键数：
  6
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  116
• 氢给体数：
  2
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  N,N'-trimethylenebis(2-nitroaniline) 在 氢气 、 potassium carbonate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 100.0h， 生成 <3.3>(3,10)isoalloxazinophane
  参考文献：
  名称：

  π...π-interactions of flavins,-II. [3.3](3,10)Isoalloxazinophane and quinhydrone-like flavin interactions

  摘要：

  DOI：

  10.1016/s0040-4039(01)80093-9
• 作为产物：
  描述：

  硝基氯苯 、 1,3-丙二胺 在 吡啶 作用下， 生成 N,N'-trimethylenebis(2-nitroaniline)
  参考文献：
  名称：

  Synthetic spectroscopic models realted to coenzymes and base pairs. VI. Synthesis of (.omega.- aralkyl)-6,7-dimethylisoalloxazines, spectroscopic model compounds related to FAD

  摘要：

  DOI：

  10.1021/jo01263a005

文献信息

• Syntheses and reactivity of bisflavins. Oxidation of N-benzyl-1,4-dihydronicotinamide by flavins in aqueous solution
  作者：Yumihiko Yano、Eiichi Ohya

  DOI：10.1039/p29840001227

  日期：——

  Several bisflavins linked at the 10,10′-positions of isoalloxazine rings have been synthesized. The kinetics of the oxidation of N-benzyl-1,4-dihydronicotinamide in aqueous solution have been examined. It has been found that each flavin of a bisflavin is considerably influenced by another intramolecular flavin moiety due to the formation of a charge-transfer complex between intramolecularly reduced

  已经合成了在异四恶嗪环的10,10'-位连接的几个双黄素。已经研究了N-苄基-1，4-二氢烟酰胺在水溶液中的氧化动力学。已经发现，由于在分子内还原的和氧化的黄素之间形成了电荷转移复合物，因此双黄素的每个黄素都受到另一种分子内的黄素部分的显着影响。复合物的形成取决于构象。
• UNUSUAL KINETIC BEHAVIOR OF BIS-FLAVIN FOR<i>N</i>-BENZYL-1,4-DIHYDRONICOTINAMIDE (BNAH) REDUCTION IN AN AQUEOUS SOLUTION
  作者：Yumihiko Yano、Eiichi Ohya

  DOI：10.1246/cl.1983.1281

  日期：1983.8.5

  Several bis-flavins linked at 10,10′-positions of isoalloxazine rings were synthesized. The reactivity of each flavin of a bis-flavin was found to be considerably influenced by another intramolecular flavin moiety, depending on the conformation of the bis-flavin.

  我们合成了几种连接在异咯嗪环 10,10′ 位上的双黄素。研究发现，双黄素中每个黄素的反应活性都会受到分子内另一个黄素分子的很大影响，这取决于双黄素的构象。
• Synthetic and structural investigations of bis(<i>N</i>-alkyl-benzoselenadiazolium) cations
  作者：Lucia Myongwon Lee、Victoria Corless、Helen Luu、Allan He、Hilary Jenkins、James F. Britten、Faisal Adam Pani、Ignacio Vargas-Baca

  DOI：10.1039/c9dt02311a

  日期：——

  macrocyclic structure in which two cations are bridged by Se⋯Cl chalcogen bonds (ChBs), with a third chloride at the centre of the macrocycle. The structure of [1,2-(H4C6NSeN)2-C6H10]Cl2 consists of two selenadiazolium cations linked by a chiral cyclohexane and capped by Se⋯Cl ChBs. Tetrafluoroborate salts of a xylene bridge crystallize in two pseudopolymorphs in which the cations form Se⋯F ChBs in an anti-

  据报道，苯并-2，1，3-硒代二唑的桥联二价衍生物的合成，光谱学和结构表征。[H 4 C 6 NSeN–CH 2 –CH 2 –NSeNC 6 H 4 ] 2+的氯化物盐结晶，形成大环结构，其中两个阳离子通过Se⋯Cl硫属元素键（ChBs）桥接，第三个氯离子为大循环的中心。[1,2-（H 4 C 6 NSeN）2 -C 6 H 10 ] Cl 2的结构由手性环己烷连接的两个硒二氮鎓阳离子组成，并被Se seCl ChBs封端。两种假多二甲苯桥结晶的四氟硼酸盐，其中阳离子形成的硒⋯˚FChBs抗-或顺式-conformation。乙烯桥连阳离子的三氟甲磺酸盐通过形成[Se–N] 2超分子合成子而二聚化，Se⋯O ChBs封端了第二个硒原子。相反，[H 4 C 6 NSeN-CH 2 -CH 2 -CH 2 -NSeNC 6 H 4 ]（CF 3 SO 3）2仅形成Se⋯O ChBs。
• Potassium channel blocking agents
  申请人：NeuroSearch A/S

  公开号：US20020049246A1

  公开（公告）日：2002-04-25

  This invention relates to novel potassium channel blocking agents, and their use in the preparation of pharmaceutical compositions. Moreover the invention is directed to pharmaceutical compositions useful for the treatment or alleviation of diseases or disorders associated with the activity of potassium channels, in particular asthma, cystic fibrosis, chronic obstructive pulmonary disease and rhinorrhea, convulsions, vascular spasms, coronary artery spasms, renal disorders, polycystic kidney disease, bladder spasms, urinary incontinence, bladder outflow obstruction, irritable bowel syndrome, gastrointestinal dysfunction, secretory diarrhoea, ischaemia, cerebral ischaemia, ischaemic hearth disease, angina pectoris, coronary hearth disease, traumatic brain injury, psychosis, anxiety, depression, dementia, memory and attention deficits, Alzheimer's disease, dysmenorrhea, narcolepsy, Reynaud's disease, intermittent claudication, Sjorgren's syndrome, migraine, arrhythmia, hypertension, absence seizures, myotonic muscle dystrophia, xerostomi, diabetes type II, hyperinsulinemia, premature labor, baldness, cancer, and immune suppression.

  本发明涉及新型钾通道阻滞剂及其在制备药物组合物中的应用。此外，本发明还涉及用于治疗或缓解与钾通道活性有关的疾病或疾病的药物组合物，特别是哮喘、囊性纤维化、慢性阻塞性肺疾病和流涕、惊厥、血管痉挛、冠状动脉痉挛、肾脏疾病、多囊肾病、膀胱痉挛、尿失禁、膀胱出流道梗阻、肠易激综合征、胃肠功能障碍、分泌性腹泻、缺血、脑缺血、缺血性心脏病、心绞痛、冠心病、创伤性脑损伤、精神病、焦虑、抑郁症、痴呆、记忆和注意力缺陷、阿尔茨海默病、痛经、嗜睡病、雷诺氏病、间歇性跛行、Sjorgren综合征、偏头痛、心律失常、高血压、失神发作、肌萎缩性肌肉营养不良、干口症、2型糖尿病、高胰岛素血症、早产、秃发、癌症和免疫抑制。
• BRIDGED AROMATIC SUBSTITUTED AMINE LIGANDS WITH DONOR ATOMS
  申请人：Kasina Sudhakar

  公开号：US20080227961A1

  公开（公告）日：2008-09-18

  The present invention provides for substituted metal chelating compounds in which at least two of the chelating atoms are nitrogen which are directly attached to aromatic rings and one or more of those nitrogen atoms has attached thereto a substituent other than hydrogen, and methods for making and using these compounds.

  本发明提供了一种取代金属螯合化合物，其中至少有两个螯合原子是直接连接到芳香环的氮原子，并且其中一个或多个氮原子上附有除氢以外的取代基，以及制备和使用这些化合物的方法。