CAS: 85815-37-8; 5-[[(2-Aminoacetyl)Amino]Methyl]-1-[4-Chloro-2-(2-Chlorobenzoyl)Phenyl]-N,N-Dimethyl-1,2,4-Triazole-3-Carboxamide,Hydrochloride

该化合物是一种复杂的有机化合物,其特征是其三硝基核心,该核心由五人组成,包含三个氮原子的热循环环.该化合物具有多种功能组,包括一种碳箱胺和一种氯苯基,有助于其潜在的生物活动.盐形式的存在表明水环境中溶性增强,往往有利于药理学应用.二氢酸盐形式表明该化合物可以将水分子纳入其晶体结构,这可能会影响其稳定性和溶解性.

英文名称5-[[(2-Aminoacetyl)Amino]Methyl]-1-[4-Chloro-2-(2-Chlorobenzoyl)Phenyl]-N,N-Dimethyl-1,2,4-Triazole-3-Carboxamide,Hydrochloride
中文名称盐酸利马扎封
CAS编号85815-37-8
MFCD编号:MFCD31544396
FDA UNII编号:25T258X8BV
分子式:C21H21Cl3N6O3分子量:511.79
产品CID: 1857130
产品分类有机原料 → 苯类化合物 → 苯和取代衍生物

相似结构搜索
产品信息参考;
InChIKey: KHINGHZNENOVFD-UHFFFAOYSA-N
InChI=1S/C21H20Cl2N6O3.ClH/c1-28(2)21(32)20-26-17(11-25-18(30)10-24)29(27-20)16-8-7-12(22)9-14(16)19(31)13-5-3-4-6-15(13)23;/h3-9H,10-11,24H2,1-2H3,(H,25,30);1H
计算化学: 氢键受体数6.0氢键供体数3.0可旋转键数7.0

MSDS等安全信息

合成工艺路线路线简述

65699-00-5 = 85815-37-8
反应条件:1.1 Reagents: Hydrazine
标题:Synthesis And Biological Activity Of (3,5-Disubstituted-1H-1,2,4-Triazol-1-Yl)Benzophenone Derivatives
作者:Hirai,Kentaro; Et Al
参考文献:Journal Of Heterocyclic Chemistry 日期:1982 卷标:19(6) 页码:1363-9]

59180-28-8 + 65698-99-9 = 85815-37-8
反应条件:1.1 -2.1 Reagents: Hydrazine
标题:Synthesis And Biological Activity Of (3,5-Disubstituted-1H-1,2,4-Triazol-1-Yl)Benzophenone Derivatives
作者:Hirai,Kentaro; Et Al
参考文献:Journal Of Heterocyclic Chemistry 日期:1982 卷标:19(6) 页码:1363-9]

85815-52-7 = 85815-37-8
反应条件:1.1 Reagents: Ammonium Hydroxide2.1 -3.1 Reagents: Hydrazine
标题:Synthesis And Biological Activity Of (3,5-Disubstituted-1H-1,2,4-Triazol-1-Yl)Benzophenone Derivatives
作者:Hirai,Kentaro; Et Al
参考文献:Journal Of Heterocyclic Chemistry 日期:1982 卷标:19(6) 页码:1363-9]

2958-36-3 + 5810-11-7 = 85815-37-8
反应条件:1.1 Reagents: Sodium Nitrite2.1 Reagents: Ammonium Hydroxide3.1 -4.1 Reagents: Hydrazine
标题:Synthesis And Biological Activity Of (3,5-Disubstituted-1H-1,2,4-Triazol-1-Yl)Benzophenone Derivatives
作者:Hirai,Kentaro; Et Al
参考文献:Journal Of Heterocyclic Chemistry 日期:1982 卷标:19(6) 页码:1363-9

📜2',5-Dichloro-2-(3-Dimethylcarbamoyl-5-Phthalylglycylaminomethyl-1H-1,2,4-Triazol-1-yl)Benzophenone,肼以83%的收率获得产物
参考文献:Hirai,Kentaro;Sugimoto,Hirohiko;Isbiba,Teruyuki;Fujishita,Toshio;Tsuk+,J. Heterocycl. Chem.,1982,19,N 6,1363-1369
标题:Hirai,Kentaro;Sugimoto,Hirohiko;Isbiba,Teruyuki;Fujishita,Toshio;Tsuk+,J. Heterocycl. Chem.,1982,19,N 6,1363-1369