3-(hydroxymethyl)phenyl 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetate -Drug Synthesis Database

【结构式】

【分子编号】48380

【品名】3-(hydroxymethyl)phenyl 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetate

【CA登记号】

【分子式】C₂₆H₂₂ClNO₅

【分子量】463.91712

【元素组成】C 67.32% H 4.78% Cl 7.64% N 3.02% O 17.24%

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：(VI)

In a related procedure, indomethacin chloride (III) was coupled with 3-hydroxybenzaldehyde (IV) to yield ester (V). Catalytic hydrogenation of the formyl group of (V) over Pd/C produced alcohol (VI), which was further converted to chloride (VII) upon treatment with SOCl2. The chloride group of (VII) was finally displaced with silver nitrate to furnish the corresponding nitrate ester.

参考文献中间体

合成目标

【1】 Garufi, M.; Del Soldato, P. (NicOx SA); Synthesis method of nitroxymethylphenyl esters of aspirin derivs.. WO 0044705 .

中间体序号	中间体编号	品名	CAS号	分子式	供应商	用于合成
(III)	24047	2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetyl chloride		C₁₉H₁₅Cl₂NO₃	详情	详情
(IV)	28537	3-hydroxybenzaldehyde	100-83-4	C₇H₆O₂	详情	详情
(V)	48379	3-formylphenyl 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetate		C₂₆H₂₀ClNO₅	详情	详情
(VI)	48380	3-(hydroxymethyl)phenyl 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetate		C₂₆H₂₂ClNO₅	详情	详情
(VII)	48381	3-(chloromethyl)phenyl 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetate		C₂₆H₂₁Cl₂NO₄	详情	详情

Extended Information