N-(2-aminoethyl) dimethylamine sulfonamide | 107674-92-0

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 有机硫酸及其衍生物
• 英文名称: N-(2-aminoethyl) dimethylamine sulfonamide
• 英文别名: N'-(2-aminoethyl)-N,N-dimethylsulfamide；1-amino-2-(dimethylsulfamoylamino)ethane
• CAS: 107674-92-0
• 化学式: C₄H₁₃N₃O₂S
• mdl: MFCD10024743
• 分子量: 167.232
• InChiKey: VXDUVINZNILVIC-UHFFFAOYSA-N

物化性质

• 沸点：
  269.5±42.0 °C(Predicted)
• 密度：
  1.235±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  -1.7
• 重原子数：
  10
• 可旋转键数：
  4
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  83.8
• 氢给体数：
  2
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  N-(2-aminoethyl) dimethylamine sulfonamide 、 1,2-epoxy-3-<2-(methoxycarbonyl)phenoxy>propane 在 三乙胺 作用下， 以 甲醇 为溶剂， 反应 4.0h， 生成 Methyl 2-[3-[2-(dimethylsulfamoylamino)ethylamino]-2-hydroxypropoxy]benzoate
  参考文献：
  名称：

  Ultra-short-acting .beta.-adrenergic receptor blocking agents. 3. Ethylenediamine derivatives of (aryloxy)propanolamines having esters on the aryl function

  摘要：

  Various ethylenediamine derivatives have been incorporated into the nitrogen substituent of certain short-acting (aryloxy)propanolamine systems that contain esters on their aryl functions. Although several of these compounds showed durations of action comparable to their prototypes, most of the nitrogen substituents significantly prolonged the duration of beta-adrenergic blockade. Similarly, while one of the compounds showed appreciable cardioselectivity in vitro, generally, little enhancement of cardioselectivity was obtained. A brief discussion of structure-activity relationships observed for the ethylenediamine derivatives is presented.

  DOI：

  10.1021/jm00362a004

文献信息

• CHEMICAL COMPOUNDS-821
  申请人：Finlay Maurice Raymond

  公开号：US20090048269A1

  公开（公告）日：2009-02-19

  The invention relates to chemical compounds of the formula (I), or pharmaceutically acceptable salts thereof, which possess ALK5 (TGFβR1) inhibitory activity and are accordingly useful for their anti-cancer activity and thus in methods of treatment of the human or animal body. The invention also relates to processes for the manufacture of said chemical compounds, to pharmaceutical compositions containing them and to their use in the manufacture of medicaments for use in the production of an anti-cancer effect in a warm-blooded animal such as man.

  该发明涉及化学式(I)的化合物，或其药学上可接受的盐，具有ALK5（TGFβR1）抑制活性，因此在抗癌活性方面有用，从而在治疗人体或动物体的方法中有用。该发明还涉及制造上述化学化合物的方法，含有它们的药物组合物，以及它们在制造用于在温血动物（如人）中产生抗癌效果的药物中的使用。
• Amino substituted dibenzothiophene derivatives for the treatment of disorders mediated by np y5 receptor
  申请人：——

  公开号：US20030225097A1

  公开（公告）日：2003-12-04

  Compounds of formula (I): 1 wherein: X is a group of formula (A) or (B): 2 and R 1 , R 2 , R 3 , R 4 , n, x, y and z are as defined within are described. Processes for their preparation and their use in the treatment of disorders mediated by the neuropeptide Y5 receptor in a warm-blooded animal, such as a human being are also described.

  式(I)的化合物： 其中： X是式(A)或(B)的基团： 而R1、R2、R3、R4、n、x、y和z的定义如所述。 还描述了它们的制备过程以及它们在治疗由神经肽Y5受体介导的疾病中的用途，如在温血动物，如人类中的用途。
• Design, synthesis and pharmacological evaluation of novel N-(2-(1, 1-dimethyl-5, 7-dioxo-4, 6-diazaspiro[2.4]heptan-6-yl)ethyl) sulfonamide derivatives as potential anticonvulsant agents
  作者：Jinping Li、Jun Lou、Zhiming Wang、Ting Wang、Yuling Xiao、Xianming Hu、Peng Liu、Xuechuan Hong

  DOI：10.1016/j.ejmech.2015.01.008

  日期：2015.3

  new N-(2-(1,1-dimethyl-5,7-dioxo-4,6-diazaspiro[2.4]heptan-6-yl)ethyl) sulfonamide derivatives (8a–i) and ethyl 2,2-dimethyl-1-(3-(2-(sulfonamido)ethyl)ureido) cyclopropanecarbox-ylate derivatives (9a–i) were designed, synthesized and evaluated for their anticonvulsant activities using maximal electroshock shock (MES) and subcutaneous pentylenetetrazole (scPTZ) seizure models in mice. N-(2-(1,1-dimethyl-5

  一系列新的N-（2-（1,1-二甲基-5,7-二氧代-4,6-二氮杂螺[2.4]庚-6-6基）乙基）磺酰胺衍生物（8a – i）和乙基2,2使用最大的电击休克（MES）和皮下戊四唑（scPTZ）设计，合成并评估了-二甲基-1-（3-（2-（磺酰胺基）乙基）脲基）环丙烷甲酸酯衍生物（9a – i）的抗惊厥活性。小鼠的癫痫发作模型。N-（2-（1,1-二甲基-5,7-二氧杂4,6-二氮杂螺[2.4]庚-6-6基）乙基）-4-氟苯甲磺酰胺（8f）和N-（2-（ 1,1-二甲基-5,7-二氧代-4,6-二氮杂螺[2.4]庚-6-6基）乙基）-4-甲基苯磺酰胺（8e）已经在MES模型中显示出有希望的抗惊厥活性。活性最高的化合物8f在小鼠腹膜内注射后显示出MES诱发的癫痫发作，ED 50值为28.05 mg / kg，TD 50值为561 mg / kg，这为化合物8f提供了保护指数（TD 50 / ED
• Design, synthesis and antibacterial activity evaluation of ebselen derivatives in NDM-1 producing bacteria
  作者：Wanli Meng、Chenyu Liu、Guangxin Wu、Zhongyue Bai、Zhihao Wang、Sheng Chen、Shengbiao Wan、Wandong Liu

  DOI：10.1039/d4md00031e

  日期：——

  restore the efficacy of meropenem (Mem) against NDM-1 producing strains. In this study, 22 compounds were designed and synthesized, which restored the Mem susceptibility of NDM-1-expressing Escherichia coli. and its minimum inhibitory concentration (MIC) was reduced by 2–16 times. Representative compound A4 showed significant synergistic antibacterial activity against NDM-1-producing carbapenem-resistant

  新德里-β-内酰胺酶-1 (NDM-1) 是一种金属-β-内酰胺酶。表达NDM-1的细菌可以通过质粒转移在全球范围内迅速传播，这极大地损害了碳青霉烯类药物的临床疗效。 NDM-1抑制剂的研究引起了广泛关注。然而，目前尚无临床可用的NDM-1抑制剂。我们的研究小组报道了1,2-benzisoselenazol-3(2 H )-one衍生物作为共价NDM-1抑制剂可以恢复美罗培南（Mem）对NDM-1产生菌株的功效。在这项研究中，设计并合成了22种化合物，恢复了表达NDM-1的大肠杆菌的Mem敏感性。其最低抑菌浓度（MIC）降低2~16倍。代表性化合物A4对产生 NDM-1 的碳青霉烯类耐药肠杆菌 (CRE) 分离株表现出显着的协同抗菌活性。体外NDM-1酶抑制活性测试显示IC 50为1.26±0.37 μM，具有较低的细胞毒性。与美罗培南合用时，表现出良好的联合抗菌活性。电喷雾电离质谱 (ESI-MS)
• Ultra-short-acting .beta.-adrenergic receptor blocking agents. 3. Ethylenediamine derivatives of (aryloxy)propanolamines having esters on the aryl function
  作者：Paul W. Erhardt、Chi M. Woo、William L. Matier、Richard J. Gorczynski、William G. Anderson

  DOI：10.1021/jm00362a004

  日期：1983.8

  Various ethylenediamine derivatives have been incorporated into the nitrogen substituent of certain short-acting (aryloxy)propanolamine systems that contain esters on their aryl functions. Although several of these compounds showed durations of action comparable to their prototypes, most of the nitrogen substituents significantly prolonged the duration of beta-adrenergic blockade. Similarly, while one of the compounds showed appreciable cardioselectivity in vitro, generally, little enhancement of cardioselectivity was obtained. A brief discussion of structure-activity relationships observed for the ethylenediamine derivatives is presented.