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【结 构 式】 
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【药物名称】 【化学名称】Sulfamic acid 4-nonanoylphenyl ester 【CA登记号】319922-34-4 【 分 子 式 】C15H23NO4S 【 分 子 量 】313.41886 |
【开发单位】Kingston University (Originator) 【药理作用】Breast Cancer Therapy, Oncolytic Drugs, Steryl Sulfatase Inhibitors |
合成路线1
Friedel-Crafts acylation of phenol (I) with nonanoyl chloride (II) in the presence of AlCl3 afforded ketone (III). Aminosulfonyl chloride (V) was prepared by decarboxylation of chlorosulfonyl isocyanate (IV) upon treatment with formic acid. Finally, condensation of the sodium phenolate of (III) with aminosulfonyl chloride (V) furnished the title sulfamate.
| 【1】 Ahmed, S.; et al.; Novel inhibitors of the enzyme estrone sulfatase (ES). Bioorg Med Chem Lett 2001, 11, 6, 841. |
| 【2】 Ahmed, S.; James, K.; Owen, C.P.; Patel, C.K.; Synthesis and biochemical evaluation of novel and potent inhibitors of the enzyme oestrone sulphatase (ES). J Steroid Biochem Mol Biol 2002, 80, 4-5, 419. |
| 【3】 Ahmed, S. (Kingston University); Sulphamate cpds.. WO 0104086 . |
| 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) | 23540 | Phenol | 108-95-2 | C6H6O | 详情 | 详情 |
| (II) | 30296 | nonanoyl chloride | 764-85-2 | C9H17ClO | 详情 | 详情 |
| (III) | 50915 | 4-n-Nonanoylphenol; 4-Hydroxynonanophenone | 14392-69-9 | C15H22O2 | 详情 | 详情 |
| (IV) | 14101 | Chlorosulfonyl isocyanate | 1189-71-5 | CClNO3S | 详情 | 详情 |
| (V) | 40598 | amidosulfonoyl chloride | 7778-42-9 | H2ClNO2S | 详情 | 详情 |
Extended Information