Methyl 5-methylsulphonylindole-2-carboxylate -Drug Synthesis Database

【结构式】

【分子编号】58559

【品名】Methyl 5-methylsulphonylindole-2-carboxylate

【CA登记号】

【分子式】C₁₁H₁₁NO₄S

【分子量】253.27868

【元素组成】C 52.16% H 4.38% N 5.53% O 25.27% S 12.66%

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：(I)

The title compound was obtained by the alkylation of methyl 5-(methylsulfonyl)indole-2-carboxylate (I) with 4-chlorobenzyl bromide (II) in the presence of KOH.

参考文献中间体

合成目标

【1】 Gallo, M.A.; Trujillo, M.A.; García, L.; Cabré, F.; Pascual, J.; Mauleón, D.; Campos, J.; Espinosa, A.; Entrena, A.; Palomer, A.; Identification of novel cyclooxygenase-2 selective inhibitors using pharmacophore models. J Med Chem 2002, 45, 7, 1402.

中间体序号	中间体编号	品名	CAS号	分子式	供应商	用于合成
(I)	58559	Methyl 5-methylsulphonylindole-2-carboxylate		C₁₁H₁₁NO₄S	详情	详情
(II)	16481	1-(bromomethyl)-4-chlorobenzene	622-95-7	C₇H₆BrCl	详情	详情

Extended Information