8-chlorodibenzo[b,f]thiepin-10-yl 2-chloroethyl ether; 2-chloro-11-(2-chloroethoxy)dibenzo[b,f]thiepine -Drug Synthesis Database

【结构式】

【分子编号】33428

【品名】8-chlorodibenzo[b,f]thiepin-10-yl 2-chloroethyl ether; 2-chloro-11-(2-chloroethoxy)dibenzo[b,f]thiepine

【CA登记号】

【分子式】C₁₆H₁₂Cl₂OS

【分子量】323.24208

【元素组成】C 59.45% H 3.74% Cl 21.94% O 4.95% S 9.92%

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)

Compound can be prepared in two different ways: 1) By condensation of 8-chlorodibenzo[b,f]thiepin-10(11H)-one (I) with 2-dimethylaminoethyl chloride (II) by means of NaH in benzene - DMF at 60 C. 2) By condensation of 8-chloro-10-(2-chloroethoxy)dibenzo[b,f]thiepin (III) with dimethylamine.

参考文献中间体

合成目标

【1】 Umio, S.; Ueta, I.; JP 7235439 .
【2】 Blancafort, P.; Serradell, M.N.; Hillier, K.; Castaner, J.; Zotepine. Drugs Fut 1979, 4, 10, 758.
【3】 Umio, S.; et al. (Fujisawa Pharmaceutical Co., Ltd.); Tricyclic enol ether compounds. DE 1907670; FR 2002064; GB 1247067; NL 6902489; US 3704245 .

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)	33427	8-chlorodibenzo[b,f]thiepin-10(11H)-one		C₁₄H₉ClOS	详情	详情
(II)	11907	Dimethylaminoethyl chloride; 2-Dimethylaminoethyl chloride; 2-Chloro-N,N-dimethyl-1-ethanamine; N-(2-Chloroethyl)-N,N-dimethylamine	107-99-3	C₄H₁₀ClN	详情	详情
(III)	33428	8-chlorodibenzo[b,f]thiepin-10-yl 2-chloroethyl ether; 2-chloro-11-(2-chloroethoxy)dibenzo[b,f]thiepine		C₁₆H₁₂Cl₂OS	详情	详情

Extended Information