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【结 构 式】

【分子编号】43750

【品名】5-bromo-2,2-diphenylpentanenitrile

【CA登记号】

【 分 子 式 】C17H16BrN

【 分 子 量 】314.22478

【元素组成】C 64.98% H 5.13% Br 25.43% N 4.46%

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:(III)

Diphenylacetonitrile (I) was alkylated with 1,3-dibromopropane (II) in the presence of NaH in DMF to afford the bromopropyl derivative (III). Subsequent condensation of bromide (III) with 4-(4-chlorophenyl)-4-hydroxypiperidine (IV) gave the tertiary amine (V). This was then quaternized with methyl iodide to furnish the corresponding piperidinium salt.

1 May, K.; Bauman, J.G.; Ng, H.P.; et al.; Discovery of novel non-peptide CCR1 receptor antagonists. J Med Chem 1999, 42, 22, 4680.
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) 14493 alpha-phenylbenzeneacetonitrile; 2,2-diphenylacetonitrile; Diphenylacetonitrile 86-29-3 C14H11N 详情 详情
(II) 12581 1,3-Dibromopropane 109-64-8 C3H6Br2 详情 详情
(III) 43750 5-bromo-2,2-diphenylpentanenitrile C17H16BrN 详情 详情
(IV) 35870 4-(4-chlorophenyl)-4-piperidinol; 4-(4-Chlorophenyl)-4-hydroxypiperidine 39512-49-7 C11H14ClNO 详情 详情
(V) 43751 5-[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]-2,2-diphenylpentanenitrile C28H29ClN2O 详情 详情
Extended Information