(5-amino-1H-indol-2-yl)[1-(chloromethyl)-5-hydroxy-8-methyl-1,6-dihydropyrrolo[3,2-e]indol-3(2H)-yl]methanone -Drug Synthesis Database

【结构式】

【分子编号】52265

【品名】(5-amino-1H-indol-2-yl)[1-(chloromethyl)-5-hydroxy-8-methyl-1,6-dihydropyrrolo[3,2-e]indol-3(2H)-yl]methanone

【CA登记号】

【分子式】C₂₁H₁₉ClN₄O₂

【分子量】394.86032

【元素组成】C 63.88% H 4.85% Cl 8.98% N 14.19% O 8.1%

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：(XIII)

Acid (XII) was coupled with the indolyl amine (XIII) by means of EDC to give amide (XIV). Finally, simultaneous removal of the Fmoc protecting group of (XIV) and cyclization of its seco-cyclopropapyrroloindole moiety were accomplished in one step by treatment with tetrabutylammonium fluoride in DMF, producing the target compound.

参考文献中间体

合成目标

【1】 Zhou, Q.; et al.; Design and synthesis of a novel DNA-DNA interstrand adenine-guanine cross-linking agent. J Am Chem Soc 2001, 123, 20, 4865.

中间体序号	中间体编号	品名	分子式	供应商	用于合成
(XII)	52264	4-{[10-{[(9H-fluoren-9-ylmethyl)oxy]carbonyl}-11-hydroxy-7-(methyloxy)-5-oxo-2,3,5,10,11,11a-hexahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-8-yl]oxy}butanoic acid	C₃₂H₃₂N₂O₈	详情	详情
(XIII)	52265	(5-amino-1H-indol-2-yl)[1-(chloromethyl)-5-hydroxy-8-methyl-1,6-dihydropyrrolo[3,2-e]indol-3(2H)-yl]methanone	C₂₁H₁₉ClN₄O₂	详情	详情
(XIV)	52266	9H-fluoren-9-ylmethyl 8-({4-[(2-{[1-(chloromethyl)-5-hydroxy-8-methyl-1,6-dihydropyrrolo[3,2-e]indol-3(2H)-yl]carbonyl}-1H-indol-5-yl)amino]-4-oxobutyl}oxy)-11-hydroxy-7-(methyloxy)-5-oxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine-10	C₅₃H₄₉ClN₆O₉	详情	详情

Extended Information