Name: A-419259
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT212080392
Cas No:364042-47-7
常用名:A-419259
别名:RK-20449, RK20449, A419259
IUPAC:5-(4-phenoxyphenyl)-7-[(1r,4r)-4-(4-methylpiperazin-1-yl)cyclohexyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine
IUPAC:5-(4-phenoxyphenyl)-7-[(1r,4r)-4-(4-methylpiperazin-1-yl)cyclohexyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine
InChI key:FDVSOQRNTAPCHB-YHBQERECSA-N

分子式:C29H34N6O
分子量:482.632
氢键供体数 (HBD):1
氢键受体数 (HBA):5
LogP:4.621098
SMILES:CN1CCN(CC1)[C@H]1CC[C@@H](CC1)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)ncnc12 |wU:7.7,wD:10.14,(3.02,-11.6,;2.54,-10.13,;1.04,-9.81,;.56,-8.35,;1.59,-7.21,;3.1,-7.53,;3.57,-8.99,;1.11,-5.74,;-.39,-5.42,;-.87,-3.96,;.16,-2.81,;1.67,-3.13,;2.14,-4.6,;-.31,-1.35,;.59,-.1,;-.31,1.15,;.16,2.61,;1.67,2.93,;2.14,4.39,;1.11,5.54,;1.59,7,;.56,8.15,;1.04,9.61,;0,10.76,;-1.5,10.44,;-1.98,8.97,;-.95,7.83,;-.39,5.22,;-.87,3.75,;-1.78,.67,;-3.11,1.44,;-3.11,2.98,;-4.45,.67,;-4.45,-.87,;-3.11,-1.64,;-1.78,-.87,)|
SMILES:CN1CCN(CC1)[C@H]1CC[C@@H](CC1)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)ncnc12 |wU:7.7,wD:10.14,(3.02,-11.6,;2.54,-10.13,;1.04,-9.81,;.56,-8.35,;1.59,-7.21,;3.1,-7.53,;3.57,-8.99,;1.11,-5.74,;-.39,-5.42,;-.87,-3.96,;.16,-2.81,;1.67,-3.13,;2.14,-4.6,;-.31,-1.35,;.59,-.1,;-.31,1.15,;.16,2.61,;1.67,2.93,;2.14,4.39,;1.11,5.54,;1.59,7,;.56,8.15,;1.04,9.61,;0,10.76,;-1.5,10.44,;-1.98,8.97,;-.95,7.83,;-.39,5.22,;-.87,3.75,;-1.78,.67,;-3.11,1.44,;-3.11,2.98,;-4.45,.67,;-4.45,-.87,;-3.11,-1.64,;-1.78,-.87,)|

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 ~