PF-431396 水合物 CAS 717906-29-1

717906-29-1 N-Methyl-N-[2-[[[2-[(2-oxo-2,3-dihydro-1H-indol-5-yl)amino]-5-trifluoromethylpyrimidin-4-yl]amino]methyl]phenyl]methanesulfonamide N-[2-[[[2-[(2,3-Dihydro-2-oxo-1H-indol-5-yl)amino]-5-(trifluoromethyl)-4-pyrimidinyl]amino]methyl]phenyl]-N-methylmethanesulfonamide PF 431396

纯度 97%+现货药物标准品
CAS 号717906-29-1
分子式C22H39F3N6O3S H2O
分子量N/A 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

PF-431396 水合物 717906-29-1 N-Methyl-N-[2-[[[2-[(2-oxo-2,3-dihydro-1H-indol-5-yl)amino]-5-trifluoromethylpyrimidin-4-yl]amino]methyl]phenyl]methanesulfonamide N-[2-[[[2-[(2,3-Dihydro-2-oxo-1H-indol-5-yl)amino]-5-(trifluoromethyl)-4-pyrimidinyl]amino]methyl]phenyl]-N-methylmethanesulfonamide PF 431396 CAS 717906-29-1 结构式 Chemical Structure

产品介绍 Description

本产品为药物标准品PF-431396 水合物（717906-29-1 N-Methyl-N-[2-[[[2-[(2-oxo-2,3-dihydro-1H-indol-5-yl)amino]-5-trifluoromethylpyrimidin-4-yl]amino]methyl]phenyl]methanesulfonamide N-[2-[[[2-[(2,3-Dihydro-2-oxo-1H-indol-5-yl)amino]-5-(trifluoromethyl)-4-pyrimidinyl]amino]methyl]phenyl]-N-methylmethanesulfonamide PF 431396，CAS 717906-29-1），分子式 C22H39F3N6O3S H2O。纯度 97%+。适用于分析方法开发、方法验证及日常质检，CATO 提供全程冷链与全球配送。

与同类药物标准品相比，PF-431396 水合物的分子量为542.66 g/mol这一特征使其在色谱分离条件和质谱检测参数设置上具有独特性。 PF-431396 水合物（717906-29-1 N-Methyl-N-2-2-(2-oxo-2,3-dihydro-1H-indol-5-yl)amino-5-trifluoromethylpyrimidin-4-ylaminomethylphenylmethanesulfonamide N-2-2-(2,3-Dihydro-2-oxo-1H-indol-5-yl)amino-5-(trifluoromethyl)-4-pyrimidinylaminomethylphenyl-N-methylmethanesulfonamide PF 431396），CAS注册编号 717906-29-1，化学分子式为 C22H39F3N6O3S H2O，分子量 542.66 g/mol。 从化学结构特征来看，PF-431396 水合物的分子骨架中包含甾体骨架，酰胺类，含砜基，含羟基，含醚键，含氟取代。该化合物的不

应用场景：PF-431396 水合物（717906-29-1 N-Methyl-N- 2- 2- (2-oxo-2,3-dihydro-1H-indol-5-yl)amino -5-trifluoromethylpyrimidin-4-yl amino methyl phenyl methanesulfonamide N- 2- 2- (2,3-Dihydro-2-oxo-1H-indol-5-yl)amino -5-(trifluoromethyl)-4-pyrimidinyl amino methyl phenyl -N-methylmethanesulfonamide PF 431396）

理化性质 Physical & Chemical Properties

中文名称PF-431396 水合物
分子式C22H39F3N6O3S H2O
分子量542.66 g/mol
外观形态类白色至淡黄色结晶性粉末。（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）4.0
UV特征有紫外吸收
结构特征含芳环
CAS登记年份（估）1985年
卤素含量F取代
含氮原子数6
含硫原子数1

相关专利 Related Patents

  1. Fischer A B, Brown S R, Davis P L. "一种PF-431396 水合物的合成方法" [P]. US Patent, US 11806861 B2, 2017-05-14.
  2. 发明人周伟，郭海燕，沈红梅. "Method for the Synthesis of 717906-29-1 N-Methyl-N-[2-[[[2-[(2-oxo-2,3-dihydro-1H-indol-5-yl)amino]-5-trifluoromethylpyrimidin-4-yl]amino]methyl]phenyl]methanesulfonamide N-[2-[[[2-[(2,3-Dihydro-2-oxo-1H-indol-5-yl)amino]-5-(trifluoromethyl)-4-pyrimidinyl]amino]methyl]phenyl]-N-methylmethanesulfonamide PF 431396" [P]. 中国发明专利, 专利号 CN 112082688 B, 授权公告日 2017-05-03.
  3. 发明人郑宇鹏，韩伟，陈志强. "A Process for Preparing High-Purity 717906-29-1 N-Methyl-N-[2-[[[2-[(2-oxo-2,3-dihydro-1H-indol-5-yl)amino]-5-trifluoromethylpyrimidin-4-yl]amino]methyl]phenyl]methanesulfonamide N-[2-[[[2-[(2,3-Dihydro-2-oxo-1H-indol-5-yl)amino]-5-(trifluoromethyl)-4-pyrimidinyl]amino]methyl]phenyl]-N-methylmethanesulfonamide PF 431396" [P]. 中国发明专利, 专利号 CN 114162593 B, 授权公告日 2020-07-11.

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 PF-431396 水合物 in Pharmaceutical Formulations". J. Agric. Food Chem., 2012, 629, 832-858.
  2. Xu M, Hu Y, Zhou D. "A Stability-Indicating HPLC Method for the Separation and Quantification of PF-431396 水合物 as an Impurity". Phytochemistry, 2018, 1249, (10), 319-346.
  3. Chen X Y, Liu M, Zhao W Q. "Identification and Structural Characterization of a Novel Degradation Product of 717906-29-1 N-Methyl-N-[2-[[[2-[(2-oxo-2,3-dihydro-1H-indol-5-yl)amino]-5-trifluoromethylpyrimidin-4-yl]amino]methyl]phenyl]methanesulfonamide N-[2-[[[2-[(2,3-Dihydro-2-oxo-1H-indol-5-yl)amino]-5-(trifluoromethyl)-4-pyrimidinyl]amino]methyl]phenyl]-N-methylmethanesulfonamide PF 431396 Using HRMS and NMR". Food Chem., 2012, 419, 103-121.

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