CAS: 406939-93-3; 1-(4,8-Bis-(2,2,2-Trifluoroacetyl)-11-{4-[4,8,11-Tris-(2,2,2-Trifluoroacetyl)-1,4,8,11-Tetraazacyclotetradec-1-Ylmethyl]-Benzyl}-1,4,8,11-Tetraazacyclotetradec-1-yl)-2,2,2-Trifluoroethanone

英文名称1-(4,8-Bis-(2,2,2-Trifluoroacetyl)-11-{4-[4,8,11-Tris-(2,2,2-Trifluoroacetyl)-1,4,8,11-Tetraazacyclotetradec-1-Ylmethyl]-Benzyl}-1,4,8,11-Tetraazacyclotetradec-1-yl)-2,2,2-Trifluoroethanone
中文名称普乐沙福杂质19
CAS编号406939-93-3
FDA UNII编号:WQ5F9W426N
分子式:C40H48F18N8O6分子量:1078.8303776
产品CID: 1420982
产品分类分析化学 → 标准品 → 药典标准品和杂质标准品

相似结构搜索
InChIKey: ZLIVMLGSJBPBRC-UHFFFAOYSA-N
1S/C40H48F18N8O6/c41-35(42,43)29(67)61-13-3-15-65(33(71)39(53,54)55)23-21-63(31(69)37(47,48)49)11-1-9-59(17-19-61)25-27-5-7-28(8-6-27)26-60-10-2-12-64(32(70)38(50,51)52)2
计算化学: 氢键受体数26.0氢键供体数*可旋转键数4.0

MSDS等安全信息

警示词warning
危险描述H303+H313+H333
防范说明P264+P280+P305+P351+P338+P337+P313
安全声明H303+H313+H333

上下游产品

1,4-bis(bromomethyl)benzene 1,1′,1″-(1,4,8,11-tetraazacyclotetradecane-1,4,8-triyl)tris-(2,2,2-trifluoroethan-1-one) 1,4,8,11-Tetraazacyclotetradecane p-Xylylene dichloride 1-[4-(1,4,8,11-tetraazacyclotetradecan-1-ylmethyl)benzyl]-1,4,8,11-tetraazacyclotetradecane

合成工艺路线路线简述

📜1,4,8,11-四氮杂环十四烷置于potassium Carbonate,三乙胺体系中,用甲醇,乙腈作为反应溶剂,化学反应 5.0H,反应生成普乐沙福杂质19
参考文献:Facile N-1 Protection Of Cyclam,Cyclen And 1,4,7-Triazacyclononane
标题:Facile N-1 Protection Of Cyclam,Cyclen And 1,4,7-Triazacyclononane
摘要:An Exceptionally High Yielding Method For The Tri-Protection Of Cyclam And Cyclen Using Ethyl Trifluoroacetate Is Described. The Selective Reaction Also Applies To The Di-Protection Of 1,4,7-Triazacyclononane. The Application Of This Method In The Synthesis Of Amd3100,A Clinical Candidate For Stem Cell Mobilization Is Presented. (C) 2003 Elsevier Science Ltd. All Rights Reserved.
DOI:10.1016/s0040-4039(03)00338-1