【结 构 式】 |
【分子编号】12083 【品名】N-[(E)-16-Azatetracyclo[7.6.1.0(2,7).0(10,15)]hexadeca-2,4,6,10,12,14-hexaen-16-ylmethylidene]-N-(tert-butyl)amine; N-[(E)-16-Azatetracyclo[7.6.1.0(2,7).0(10,15)]hexadeca-2,4,6,10,12,14-hexaen-16-ylmethylidene]-2-methyl-2-propanamine 【CA登记号】 |
【 分 子 式 】C20H22N2 【 分 子 量 】290.40816 【元素组成】C 82.72% H 7.64% N 9.65% |
与该中间体有关的原料药合成路线共 1 条
合成路线1
该中间体在本合成路线中的序号:(II)A new synthesis of [11C]-labeled MK-801 has been reported: The reaction of 10,11-dihydro-5H-dibenzo[a,d]cycloheptene (I) with N,N-dimethyl-N'-tert-butylformamidine in refluxing toluene gives the formamidine (II), which is alkylated with butyllithium and [11C]-labeled methyl iodide in ether-cyclohexane to yield the 5-methyl derivative (III). Finally, this compound is hydrolyzed with KOH in ethylene glycol.
【1】 Kiesewetter, D.O.; Rice, K.C.; Finn, R.D.; Monn, J.A.; Synthesis of C-11-labeled (+/-)-5-methyl-10,11-dihydro-5H-dibenzo[a,d]c yclohepten-5,10-imine [(+/-)-[C-11]MK801]. Appl Radiat Isot - Int J Radiat Appl Instrum Part A 1990, 41, 2, 139. |
中间体序号 | 中间体编号 | 品名 | CAS号 | 分子式 | 供应商 | 用于合成 |
---|---|---|---|---|---|---|
63418 | N'-(tert-butyl)-N,N-dimethyliminoformamide | C7H16N2 | 详情 | 详情 | ||
(I) | 12082 | 16-Azatetracyclo[7.6.1.0(2,7).0(10,15)]hexadeca-2,4,6,10,12,14-hexaene | C15H13N | 详情 | 详情 | |
(II) | 12083 | N-[(E)-16-Azatetracyclo[7.6.1.0(2,7).0(10,15)]hexadeca-2,4,6,10,12,14-hexaen-16-ylmethylidene]-N-(tert-butyl)amine; N-[(E)-16-Azatetracyclo[7.6.1.0(2,7).0(10,15)]hexadeca-2,4,6,10,12,14-hexaen-16-ylmethylidene]-2-methyl-2-propanamine | C20H22N2 | 详情 | 详情 | |
(III) | 12084 | N-(tert-Butyl)-N-[(E)-(1-methyl-16-azatetracyclo[7.6.1.0(2,7).0(10,15)]hexadeca-2,4,6,10,12,14-hexaen-16-yl)methylidene]amine; 2-Methyl-N-[(E)-(1-methyl-16-azatetracyclo[7.6.1.0(2,7).0(10,15)]hexadeca-2,4,6,10,12,14-hexaen-16-yl)methylidene]-2-propanamine | C21H24N2 | 详情 | 详情 | |
(III) | 45108 | N-(tert-butyl)-N-[(E)-(1-methyl-16-azatetracyclo[7.6.1.0(2,7).0(10,15)]hexadeca-2,4,6,10,12,14-hexaen-16-yl)methylidene]amine; 2-methyl-N-[(E)-(1-methyl-16-azatetracyclo[7.6.1.0(2,7).0(10,15)]hexadeca-2,4,6,10,12,14-hexaen-16-yl)methylidene]-2-propanamine | C21H24N2 | 详情 | 详情 |
Extended Information