N-(6-chloro-2-methyl-4-pyrimidinyl)-N-(2,4,6-trichlorophenyl)amine; 6-chloro-2-methyl-N-(2,4,6-trichlorophenyl)-4-pyrimidinamine -Drug Synthesis Database

【结构式】

【分子编号】32324

【品名】N-(6-chloro-2-methyl-4-pyrimidinyl)-N-(2,4,6-trichlorophenyl)amine; 6-chloro-2-methyl-N-(2,4,6-trichlorophenyl)-4-pyrimidinamine

【CA登记号】

【分子式】C₁₁H₇Cl₄N₃

【分子量】323.0076

【元素组成】C 40.9% H 2.18% Cl 43.9% N 13.01%

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)

The condensation of 4,6-dichloro-2-methylpyrimidine (I) with 2,4,6-trichloroaniline (II) by means of NaH in THF gives N-(6-chloro-2-methylpyrimidin-4-yl)-N-(2,4,6-trichlorophenyl)amine (III), which is condensed with N-(cyclopropylmethyl)-N-propylamine (IV) by heating at 100-190 C yielding N-(cyclopropylmethyl)-N-[2-methyl-6-(2,4,6-trichlorophenylamino)-pyrimidin-4-yl]-N-propylamine (V). Finally, this compound is chlorinated with N-chlorosuccinimide (NCS) in refluxing chloroform.

参考文献中间体

合成目标

【1】 Dagnino, R. jr.; Chen, C.; de Souzza, E.B.; et al.; Design and synthesis of a series of non-peptide high-affinity human corticotropin-releasing factor1 receptor antagonists. J Med Chem 1996, 39, 22, 4360.

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)	32323	4,6-dichloro-2-methylpyrimidine	1780-26-3	C₅H₄Cl₂N₂	详情	详情
(II)	15466	2,4,6-Trichloroaniline; 2,4,6-Trichlorophenylamine	634-93-5	C₆H₄Cl₃N	详情	详情
(III)	32324	N-(6-chloro-2-methyl-4-pyrimidinyl)-N-(2,4,6-trichlorophenyl)amine; 6-chloro-2-methyl-N-(2,4,6-trichlorophenyl)-4-pyrimidinamine		C₁₁H₇Cl₄N₃	详情	详情
(IV)	27745	N-(cyclopropylmethyl)-1-propanamine	26389-60-6	C₇H₁₅N	详情	详情
(V)	32325	N-(cyclopropylmethyl)-N-[2-methyl-6-(2,4,6-trichloroanilino)-4-pyrimidinyl]-N-propylamine; N(4)-(cyclopropylmethyl)-2-methyl-N(4)-propyl-N(6)-(2,4,6-trichlorophenyl)-4,6-pyrimidinediamine		C₁₈H₂₁Cl₃N₄	详情	详情

Extended Information