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【结 构 式】

【分子编号】21502

【品名】5-isoquinolinesulfonyl chloride hydrochloride

【CA登记号】

【 分 子 式 】C9H7Cl2NO2S

【 分 子 量 】264.13152

【元素组成】C 40.93% H 2.67% Cl 26.84% N 5.3% O 12.11% S 12.14%

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:(II)

5-Isoquinolinesulfonic acid (I) is heated at 85 C with SOCl2 and DMF yielding 5-isoquinolinesulfonyl chloride hydrochloride (II). The reaction of (II) with hexahydro-1H-1,4-diazepine affords hexahydro-1-(5-isoquinolinesulfonyl)-1H-1,4-diazepine (III) in CH2Cl2. Finally, the reaction of (III) with HCl gives hexahydro-1-(5-isoquinolinesulfonyl)-1H-1,4-diazepine hydrochloride (IV). (scheme 10964901a)

1 Ishida, T.; Asano, T.; HA 1077. Drugs Fut 1989, 14, 12, 1159.
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) 21501 5-isoquinolinesulfonic acid 27655-40-9 C9H7NO3S 详情 详情
(II) 21502 5-isoquinolinesulfonyl chloride hydrochloride C9H7Cl2NO2S 详情 详情
(III) 21503 5-(1,4-diazepan-1-ylsulfonyl)isoquinoline C14H17N3O2S 详情 详情
(IV) 25030 1,4-diazepane 505-66-8 C5H12N2 详情 详情
Extended Information