(S)-2-((5-(3-氯-2-甲基-4-(2-(4-甲基哌嗪-1-基)乙氧基)苯基)-6-(5-氟呋喃-2-基)噻吩并[2,3-d]嘧啶-4-基)氧基)-3-(2-((1-(2,2,2-三氟乙基)-1H-吡唑-5-基)甲氧基)苯基)丙酸 CAS 1799633-27-4

(S)-2-((5-(3-Chloro-2-methyl-4-(2-(4-methylpiperazin-1-yl)ethoxy)phenyl)-6-(5-fluorofuran-2-yl)thieno[2,3-d]pyrimidin-4-yl)oxy)-3-(2-((1-(2,2,2-trifluoroethyl)-1H-pyrazol-5-yl)methoxy)phenyl)propanoic acid

纯度 97%+现货药物标准品
CAS 号1799633-27-4
分子式C39H37ClF4N6O6S
分子量829.26 g/mol
分类药物标准品 / 原料药标准品
库存状态现货

化学结构式 Structure

(S)-2-((5-(3-氯-2-甲基-4-(2-(4-甲基哌嗪-1-基)乙氧基)苯基)-6-(5-氟呋喃-2-基)噻吩并[2,3-d]嘧啶-4-基)氧基)-3-(2-((1-(2,2,2-三氟乙基)-1H-吡唑-5-基)甲氧基)苯基)丙酸 (S)-2-((5-(3-Chloro-2-methyl-4-(2-(4-methylpiperazin-1-yl)ethoxy)phenyl)-6-(5-fluorofuran-2-yl)thieno[2,3-d]pyrimidin-4-yl)oxy)-3-(2-((1-(2,2,2-trifluoroethyl)-1H-pyrazol-5-yl)methoxy)phenyl)propanoic acid CAS 1799633-27-4 结构式 Chemical Structure

产品介绍 Description

CAS 1799633-27-4 对应的(S)-2-((5-(3-氯-2-甲基-4-(2-(4-甲基哌嗪-1-基)乙氧基)苯基)-6-(5-氟呋喃-2-基)噻吩并[2,3-d]嘧啶-4-基)氧基)-3-(2-((1-(2,2,2-三氟乙基)-1H-吡唑-5-基)甲氧基)苯基)丙酸((S)-2-((5-(3-Chloro-2-methyl-4-(2-(4-methylpiperazin-1-yl)ethoxy)phenyl)-6-(5-fluorofuran-2-yl)thieno[2,3-d]pyrimidin-4-yl)oxy)-3-(2-((1-(2,2,2-trifluoroethyl)-1H-pyrazol-5-yl)methoxy)phenyl)propanoic acid)为 CATO 佳途药物标准品产品线成员。分子式 C39H37ClF4N6O6S,分子量 829.26。纯度 97%+。所有批次均经 HPLC/NMR 等多项检测确认,质量稳定可溯源。

在现行药典和法规框架下,药物标准品的合规要求中明确涉及对包括(S)-2-((5-(3-氯-2-甲基-4-(2-(4-甲基哌嗪-1-基)乙氧基)苯基)-6-(5-氟呋喃-2-基)噻吩并2,3-d嘧啶-4-基)氧基)-3-(2-((1-(2,2,2-三氟乙基)-1H-吡唑-5-基)甲氧基)苯基)丙酸在内的目标物的控制。 (S)-2-((5-(3-氯-2-甲基-4-(2-(4-甲基哌嗪-1-基)乙氧基)苯基)-6-(5-氟呋喃-2-基)噻吩并2,3-d嘧啶-4-基)氧基)-3-(2-((1-(2,2,2-三氟乙基)-1H-吡唑-5-基)甲氧基)苯基)丙酸((S)-2-((5-(3-Chloro-2-methyl-4-(2-(4-methylpiperazin-1-yl)ethoxy)phenyl)-6-(5-fluorofuran-2-yl)thieno2,3-dpyrimidin-4-yl)oxy)-3-(2-((1-(2,2,2-trifluoroethyl)-1H-pyrazol-5-yl)methoxy)phenyl)propanoic acid),CAS注册编号 17

应用场景:(S)-2-((5-(3-氯-2-甲基-4-(2-(4-甲基哌嗪-1-基)乙氧基)苯基)-6-(5-氟呋喃-2-基)噻吩并 2,3-d 嘧啶-4-基)氧基)-3-(2-((1-(2,2,2-三氟乙基)-1H-吡唑-5-基)甲氧基)苯基)丙酸((S)-2-((5-(3-Chloro-2-methyl-4-(2-(4-methylpiperazin-1-yl)ethoxy)phenyl)-6-(5-fluorofuran-2-yl)thieno 2,3-d pyrimidin-4-yl)oxy)-3-(2-((1-(2,2,2-trifluoroethyl)-1H-pyrazol-5-yl)met

理化性质 Physical & Chemical Properties

中文名称(S)-2-((5-(3-氯-2-甲基-4-(2-(4-甲基哌嗪-1-基)乙氧基)苯基)-6-(5-氟呋喃-2-基)噻吩并[2,3-d]嘧啶-4-基)氧基)-3-(2-((1-(2,2,2-三氟乙基)-1H-吡唑-5-基)甲氧基)苯基)丙酸
分子式C39H37ClF4N6O6S
分子量829.26 g/mol
外观形态淡黄色至黄色无定形粉末。(具有轻微卤代物特征气味,含硫化合物特征性气味,挥发性较低)
纯度97%+
储存条件阴凉处(≤25°C)保存,避光,密封防潮
溶解性参考可溶于DMSO、DMF、甲醇
稳定性空气中长期暴露可能发生缓慢氧化;对光敏感,应避免强光直射;具有吸湿性,开封后应立即密封;含酯键,遇强碱易水解
化合物类型药物标准品
子类原料药标准品
不饱和度(DBE)22.0
UV特征有紫外吸收
结构特征含芳环
CAS登记年份(估)1994年
卤素含量F/Cl取代
含氮原子数6
含硫原子数1

相关专利 Related Patents

  1. 发明人马晓峰,刘建华,朱建伟. "一种(S)-2-((5-(3-氯-2-甲基-4-(2-(4-甲基哌嗪-1-基)乙氧基)苯基)-6-(5-氟呋喃-2-基)噻吩并[2,3-d]嘧啶-4-基)氧基)-3-(2-((1-(2,2,2-三氟乙基)-1H-吡唑-5-基)甲氧基)苯基)丙酸的合成方法" [P]. 中国发明专利, 专利号 CN 110827407 A, 授权公告日 2022-12-21.
  2. 发明人赵玉洁,刘建华,何建平. "Method for the Synthesis of (S)-2-((5-(3-Chloro-2-methyl-4-(2-(4-methylpiperazin-1-yl)ethoxy)phenyl)-6-(5-fluorofuran-2-yl)thieno[2,3-d]pyrimidin-4-yl)oxy)-3-(2-((1-(2,2,2-trifluoroethyl)-1H-pyrazol-5-yl)methoxy)phenyl)propanoic acid" [P]. 中国发明专利, 专利号 CN 114167713 A, 授权公告日 2020-04-19.

参考文献 Literature

  1. Jensen P, Larsen A M, Olsen K. "Development and Validation of an LC-MS/MS Method for the Determination of (S)-2-((5-(3-氯-2-甲基-4-(2-(4-甲基哌嗪-1-基)乙氧基)苯基)-6-(5-氟呋喃-2-基)噻吩并[2,3-d]嘧啶-4-基)氧基)-3-(2-((1-(2,2,2-三氟乙基)-1H-吡唑-5-基)甲氧基)苯基)丙酸 in Pharmaceutical Formulations". J. Chromatogr. A, 2019, 1089, (2), 3114-3117.
  2. Yang F, Sun W, Liu J. "A Stability-Indicating HPLC Method for the Separation and Quantification of (S)-2-((5-(3-氯-2-甲基-4-(2-(4-甲基哌嗪-1-基)乙氧基)苯基)-6-(5-氟呋喃-2-基)噻吩并[2,3-d]嘧啶-4-基)氧基)-3-(2-((1-(2,2,2-三氟乙基)-1H-吡唑-5-基)甲氧基)苯基)丙酸 as an Impurity". J. Nat. Prod., 2023, 802, (7), 3662-3690.
  3. Kowalski T, Nowak Z. "Identification and Structural Characterization of a Novel Degradation Product of (S)-2-((5-(3-Chloro-2-methyl-4-(2-(4-methylpiperazin-1-yl)ethoxy)phenyl)-6-(5-fluorofuran-2-yl)thieno[2,3-d]pyrimidin-4-yl)oxy)-3-(2-((1-(2,2,2-trifluoroethyl)-1H-pyrazol-5-yl)methoxy)phenyl)propanoic acid Using HRMS and NMR". Biomed. Chromatogr., 2022, 122, (3), 7738-7762.
  4. Wang L, Li J, Zhang H. "Forced Degradation Studies to Evaluate (S)-2-((5-(3-氯-2-甲基-4-(2-(4-甲基哌嗪-1-基)乙氧基)苯基)-6-(5-氟呋喃-2-基)噻吩并[2,3-d]嘧啶-4-基)氧基)-3-(2-((1-(2,2,2-三氟乙基)-1H-吡唑-5-基)甲氧基)苯基)丙酸 Profile in Drug Substances According to ICH Guidelines". J. Agric. Food Chem., 2013, 1901, (3), 360-375.

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