N-(4-chlorophenethyl)hydrazinecarboximidamide | 65746-39-6

• 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: N-(4-chlorophenethyl)hydrazinecarboximidamide
• 英文别名: 1-Amino-2-[2-(4-chlorophenyl)ethyl]guanidine
• CAS: 65746-39-6
• 化学式: C₉H₁₃ClN₄
• 分子量: 212.682
• InChiKey: BYHCOTZAHSZNOH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.9
• 重原子数：
  14
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.22
• 拓扑面积：
  76.4
• 氢给体数：
  3
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  N-(4-chlorophenethyl)hydrazinecarboximidamide 、 4-氯苯甲醛 以 乙醇 为溶剂， 生成
  参考文献：
  名称：

  Anticoccidials. II. Autoxidation and structural determination of 1-benzylamino-3-substituted guanidines.

  摘要：

  结合我们对抗球虫药物的研究，我们制备了一些1-(4-氯苄基氨基)-3-取代胍对甲苯磺酸盐（3）。通过将3自氧化为相应的苄叉氨基胍（5），证明了氨基胍的结构。

  DOI：

  10.1248/cpb.25.3099
• 作为产物：
  描述：

  N-[2-(4-chlorophenyl)ethyl](methylsulfanyl)methanimidamide hydroiodide 生成 N-(4-chlorophenethyl)hydrazinecarboximidamide
  参考文献：
  名称：

  Anticoccidials. II. Autoxidation and structural determination of 1-benzylamino-3-substituted guanidines.

  摘要：

  结合我们对抗球虫药物的研究，我们制备了一些1-(4-氯苄基氨基)-3-取代胍对甲苯磺酸盐（3）。通过将3自氧化为相应的苄叉氨基胍（5），证明了氨基胍的结构。

  DOI：

  10.1248/cpb.25.3099

文献信息

• Discovery of a small molecule RXFP3/4 agonist that increases food intake in rats upon acute central administration
  作者：Brian DeChristopher、Soo-Hee Park、Linh Vong、Derek Bamford、Hyun-Hee Cho、Rohit Duvadie、Allison Fedolak、Christopher Hogan、Toshiyuki Honda、Pramod Pandey、Olga Rozhitskaya、Liansheng Su、Elizabeth Tomlinson、Iain Wallace

  DOI：10.1016/j.bmcl.2019.02.013

  日期：2019.4

  The relaxin family peptide receptors have been implicated in numerous physiological processes including energy homeostasis, cardiac function, wound healing, and reproductive function. Two family members, RXFP3 and RXFP4, are class A GPCRs with endogenous peptide ligands (relaxin-3 and insulin-like peptide 5 (INSL5), respectively). Polymorphisms in relaxin-3 and RXFP3 have been associated with obesity, diabetes, and hyper-cholesterolemia. Moreover, central administration of relaxin-3 in rats has been shown to increase food intake, leading to body weight gain. Reported RXFP3 and RXFP4 ligands have been restricted to peptides (both endogenous and synthetic) as well as a low molecular weight positive allosteric modulator requiring a non-endogenous orthosteric ligand. Described here is the discovery of the first potent low molecular weight dual agonists of RXFP3/4. The scaffold identified is competitive with a chimeric relaxin-3/INSL5 peptide for RXFP3 binding, elicits similar downstream signaling as relaxin-3, and increases food intake in rats following acute central administration. This is the first report of small molecule RXFP3/4 agonism.
• Anticoccidials. II. Autoxidation and structural determination of 1-benzylamino-3-substituted guanidines.
  作者：JUNYA OKADA、TAKUJI SEO、KINICHI IMAI

  DOI：10.1248/cpb.25.3099

  日期：——

  In connection with our studies on anticoccidial agents, some 1-(4-chlorobenzylamino)-3-substituted guanidine tosylates (3) were prepared. The structure of the aminoguanidines was proven by autoxidation of 3 into the corresponding benzylideneaminoguanidine (5).

  结合我们对抗球虫药物的研究，我们制备了一些1-(4-氯苄基氨基)-3-取代胍对甲苯磺酸盐（3）。通过将3自氧化为相应的苄叉氨基胍（5），证明了氨基胍的结构。