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【结 构 式】

【药物名称】Batebulast hydrochloride, NCO-650

【化学名称】trans-4-Guanidinomethylcyclohexanecarboxylic acid 4-(1,1-dimethylethyl)phenyl ester hydrochloride

【CA登记号】83373-31-3, 81907-78-0 (free base)

【 分 子 式 】C19H30ClN3O2

【 分 子 量 】367.92285

【开发单位】Nippon Chemiphar (Originator)

【药理作用】Antiallergy/Antiasthmatic Drugs, Asthma Therapy, RESPIRATORY DRUGS, Mediator Release Inhibitors

合成路线1

By esterification of trans-4-guanidinomethylcyclohexanecarboxylic acid (I) with 4-tert-butylphenol (II) using dicyclohexylcarbodiimide as condensing agent.

1 Muramatsu, M.; et al.; Guanidinocyclohexanecarboxylic acid derivatives. BE 0891790; CH 652119; DE 3201817; FR 2498183; US 4465851 .
2 Serradell, M.N.; Castaner, J.; NCO-650. Drugs Fut 1984, 9, 8, 589.
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) 23059 4-([[amino(imino)methyl]amino]methyl)cyclohexanecarboxylic acid C9H17N3O2 详情 详情
(II) 29734 4-(tert-butyl)phenol 98-54-4 C10H14O 详情 详情
Extended Information