329216-67-3

• 常用中文名：2-(4-(二苯并[b,f][1,4]硫氮杂卓-11-基)哌嗪-1-基)乙醇
• 常用英文名：4-Dibenzo[b,f][1,4]thiazepin-11-yl-1-piperazineethanol
• CAS号：329216-67-3
• 分子式：C₁₉H₂₁N₃OS
• 分子量：339.454
• 发布时间：2018-03-22 08:00:00
• 更新时间：2024-01-03 11:06:30

名称

• 中文名: 4-二苯并[b,f][1,4]硫氮杂卓-11-基-1-哌嗪乙醇
• 英文名: 2-(4-benzo[b][1,4]benzothiazepin-6-ylpiperazin-1-yl)ethanol
• 中文别名: 富马酸喹硫平杂质 I
• 英文别名: 1-Piperazineethanol, 4-dibenzo[b,f][1,4]thiazepin-11-yl-; Quetiapine Hydroxy Impurity Dihydrochloride Salt; 2-[4-(Dibenzo[b,f][1,4]thiazepin-11-yl)piperazin-1-yl]ethanol; 4-Dibenzo[b,f][1,4]thiazepin-11-yl-1-piperazineethanol; T C676 BS INJ C- AT6N DNTJ D2Q; O-Dealkyl Quetiapine; 2-[4-(Dibenzo[b,f][1,4]thiazepin-11-yl)-1-piperazinyl]ethanol; Quetiapine Hydroxy Impurity; 4-Dibenzo[b,f][1,4]thiazepin-11-yl-1-piperazineethanol; Quetiapine Impurity 2

物化性质

• 密度: 1.3±0.1 g/cm3
• 沸点: 523.4±60.0 °C at 760 mmHg
• 分子式: C₁₉H₂₁N₃OS
• 分子量: 339.454
• 闪点: 270.3±32.9 °C
• 精确质量: 339.140533
• PSA: 64.37000
• LogP: 2.27
• 蒸汽压: 0.0±1.4 mmHg at 25°C
• 折射率: 1.683
• 储存条件: 2-8°C

合成路线

103-76-4 13745-86-3 ~51% 329216-67-3

文献：CONCERT PHARMACEUTICALS INC. Patent: WO2008/66620 A2, 2008 ; Location in patent: Page/Page column 23-24 ;

5747-48-8 540-51-2 ~83% 329216-67-3

文献：AUSPEX PHARMACEUTICALS, INC. Patent: US2010/69356 A1, 2010 ; Location in patent: Page/Page column 26-27 ; US 20100069356 A1

103-76-4 546-68-9 3159-07-7 ~92% 329216-67-3 详细

文献：UNION QUIMICO-FARMACEUTICA S.A. Patent: WO2006/94549 A1, 2006 ; Location in patent: Page/Page column 17-18 ;

3159-07-7 ~% 329216-67-3

文献：Warawa; Migler; Ohnmacht; Needles; Gatos; McLaren; Nelson; Kirkland Journal of Medicinal Chemistry, 2001 , vol. 44, # 3 p. 372 - 389

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