CAS: 587841-73-4; 2-(4-Bromo-2-Chlorophenoxy)-N-((4-(N-(4,6-Dimethylpyrimidin-2-yl)Sulfamoyl)Phenyl)Carbamothioyl)Acetamide

• 英文名称2-(4-Bromo-2-Chlorophenoxy)-N-((4-(N-(4,6-Dimethylpyrimidin-2-yl)Sulfamoyl)Phenyl)Carbamothioyl)Acetamide
• 中文名称2-(4-溴-2-氯苯氧基)-N-[[[4-[[(4,6-二甲基-2-嘧啶基)氨基]磺酰基]苯基]氨基]硫代甲酰基]乙酰胺
• IUPAC名称2-(4-bromo-2-chlorophenoxy)-N-((4-(N-(4,6-dimethylpyrimidin-2-yl)sulfamoyl)phenyl)carbamothioyl)acetamide
• 其它别名2-(4-Bromo-2-Chlorophenoxy)-N-(4-(N-(4,6-Dimethylpyrimidin-2-yl)Sulfamoyl)Phenylcarbamothioyl)Acetamide; 2-(4-Bromo-2-Chlorophenoxy)-N-[[[4-[[(4,6-Dimethyl-2-Pyrimidinyl)Amino]Sulfonyl]Phenyl]Amino]Thioxomethyl]Acetamide; 2-(4-Bromo-2-Chlorophenoxy)-N-((4-(N-(4,6-Dimethylpyrimidin-2-yl)Sulfamoyl)Phenyl)Carbamothioy
• CAS编号587841-73-4
• MFCD编号:MFCD03623090
• 分子式:C21H19BrClN5O4S2分子量:584.91
• 产品CID: 1562946
• 产品分类Inhibitors/Agonists → GPCR/G Protein → Ras | Inhibitors/Agonists → Anti-infection → Influenza Virus | Inhibitors/Agonists → Cell Cycle → CDK | Inhibitors/Agonists → Cell Cycle → Rho | Inhibitors/Agonists → Anti-infection → Dengue Virus

• 相似结构搜索
• InChIKey: XKZDWYDHEBCGCG-UHFFFAOYSA-N
• InChI=1S/C21H19BrClN5O4S2/c1-12-9-13(2)25-20(24-12)28-34(30,31)16-6-4-15(5-7-16)26-21(33)27-19(29)11-32-18-8-3-14(22)10-17(18)23/h3-10H,11H2,1-2H3,(H,24,25,28)(H2,26,27,2
• 计算化学: 氢键受体数9.0氢键供体数3.0可旋转键数10.0

物理性质

• 密度1.636±0.06 g/cm3 (20 ºC 760 Torr),
• PSA:166.27
• LogP:6.2692
• 溶解性≥29.25 mg/mL In DMSO; Insoluble In H2O; Insoluble In Etoh
• 外观形态白色至淡黄色浅米色固体
• 储存条件+2C to +8C
• 产品应用该化合物是一种选择性的CDC42 GTPASE抑制器(KD = 11.4 微克M),抑制CDC42介介型的纤维虫迪亚形成,扰乱血清饿死的瑞士3T3纤维块中的GOLGI组织GM130联系组织,抑制了CD42依赖的中子分流,生长锥体动态和转移性前列腺癌PC-3细胞中无细胞毒性的转移性迁移能力.

MSDS等安全信息

• GHS符号GHS07,GHS08,GHS09
• 警示词Danger
• 危险描述H302-H410-H372
• 防范说明P260-P264-P273-P501

上下游产品

合成工艺路线路线简述

海关参考信息

• 2903919090-氯苯
  2912110000-甲醛
  2912120000-乙醛
  2922110001-单乙醇胺
• 💡 提示：海关信息按照顺序优先匹配，如需确认的海关信息，请参考相关资料。
• 详情请参考：📖 海关编码查询和海关进出口税则

其他信息查阅

• ➥ 象形图和危险代码
• ➥ 防范代码详解
• ➥ 危险代码说明
• ➥ Globally Harmonized System
• ➥ REACH监管