Name: PF-03654746 Tosylate
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214314680
Cas No:1039399-17-1
常用名:PF-03654746 Tosylate
IUPAC:(1r,3r)-N-ethyl-3-fluoro-3-{3-fluoro-4-[(pyrrolidin-1-yl)methyl]phenyl}cyclobutane-1-carboxamide; 4-methylbenzene-1-sulfonic acid
IUPAC:(1r,3r)-N-ethyl-3-fluoro-3-{3-fluoro-4-[(pyrrolidin-1-yl)methyl]phenyl}cyclobutane-1-carboxamide; 4-methylbenzene-1-sulfonic acid
InChI key:IKAYTZLLIWAEDV-WXWMPIANSA-N

分子式:C25H32F2N2O4S
分子量:494.6
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:Cc1ccc(cc1)S(O)(=O)=O.CCNC(=O)[C@H]1C[C@](F)(C1)c1ccc(CN2CCCC2)c(F)c1 |wU:16.15,18.21,wD:18.18,(,-4.06,;,-2.52,;1.33,-1.75,;1.33,-.21,;,.56,;-1.33,-.21,;-1.33,-1.75,;,2.1,;1.54,2.1,;,3.64,;-1.54,2.1,;5.72,-7.31,;7.05,-6.54,;7.05,-5,;8.39,-4.23,;9.72,-5,;8.39,-2.69,;7.3,-1.61,;8.39,-.52,;7.3,.57,;9.48,-1.61,;9.48,.57,;10.96,.17,;12.05,1.26,;11.65,2.75,;12.74,3.84,;14.23,3.44,;15.43,4.41,;16.72,3.57,;16.32,2.08,;14.78,2,;10.17,3.15,;9.77,4.64,;9.08,2.06,)|
SMILES:Cc1ccc(cc1)S(O)(=O)=O.CCNC(=O)[C@H]1C[C@](F)(C1)c1ccc(CN2CCCC2)c(F)c1 |wU:16.15,18.21,wD:18.18,(,-4.06,;,-2.52,;1.33,-1.75,;1.33,-.21,;,.56,;-1.33,-.21,;-1.33,-1.75,;,2.1,;1.54,2.1,;,3.64,;-1.54,2.1,;5.72,-7.31,;7.05,-6.54,;7.05,-5,;8.39,-4.23,;9.72,-5,;8.39,-2.69,;7.3,-1.61,;8.39,-.52,;7.3,.57,;9.48,-1.61,;9.48,.57,;10.96,.17,;12.05,1.26,;11.65,2.75,;12.74,3.84,;14.23,3.44,;15.43,4.41,;16.72,3.57,;16.32,2.08,;14.78,2,;10.17,3.15,;9.77,4.64,;9.08,2.06,)|

PF-03654746 Tosylate is selective antagonist of histamine H3 receptor with high brain penetration.

市场产品/服务共显示1个结果

您无法确定哪种化合物库最适合您的项目？或者您需要定制解决方案？Anymole随时为您提供帮助。

电话：400820-0310

合作：info@screeningcompound.com

技术支持：tech@screeningcompound.com

客服：service@screeningcompound.com

正在加载 ~