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【结 构 式】 
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【药物名称】 【化学名称】2-[2-(5-Bromo-2-methoxybenzylsulfanyl)-3-chlorophenyl]-1,4,5,6-tetrahydropyrimidine 【CA登记号】325823-79-8 【 分 子 式 】C18H18BrClN2OS 【 分 子 量 】425.77796 |
【开发单位】Millennium (Originator) 【药理作用】AIDS Medicines, ANTIINFECTIVE THERAPY, METABOLIC DRUGS, Treatment of Anorexia Nervosa, Treatment of Cachexia, Treatment of Eating Disorders, Treatment of Nutritional Disorders, Melanocortin MC4 Antagonists |
合成路线1
Condensation of 3-chloro-thiosalicylic acid (I) with 1,3-propanediamine (II) in boiling ortho-dichlorobenzene leads to the cyclic amidine (III). Subsequent alkylation of the thiol group of (III) with 5-bromo-2-methoxybenzyl chloride (IV) furnishes the target thioether
| 【1】 Maguire, M.P.; Dai, M.; Vos, T.J. (Millennium Pharmaceuticals, Inc.); Melanocortin-4 receptor binding cpds. and methods of use thereof. WO 0110842 . |
| 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) | 62066 | 3-chloro-2-sulfanylbenzoic acid | C7H5ClO2S | 详情 | 详情 | |
| (II) | 19331 | 3-aminopropylamine; 1,3-propanediamine | 109-76-2 | C3H10N2 | 详情 | 详情 |
| (III) | 62067 | 2-chloro-6-(1,4,5,6-tetrahydro-2-pyrimidinyl)benzenethiol; 2-chloro-6-(1,4,5,6-tetrahydro-2-pyrimidinyl)phenylhydrosulfide | C10H11ClN2S | 详情 | 详情 | |
| (IV) | 62068 | 4-bromo-2-(chloromethyl)-1-methoxybenzene; 4-bromo-2-(chloromethyl)phenyl methyl ether | C8H8BrClO | 详情 | 详情 |
Extended Information