1775384-52-5 ((N-{1-[2-methyl-6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl}isoquinoline-1-carboxamide)

快速询单

结构式：

N-{1-[2-methyl-6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl}isoquinoline-1-carboxamideMOL文件

CAS号：

1775384-52-5

英文名称：

N-{1-[2-methyl-6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl}isoquinoline-1-carboxamide

分子式：

C₂₁H₂₀F₃N₅O

分子量：

415.4116

N-{1-[2-methyl-6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl}isoquinoline-1-carboxamide(1775384-52-5)名称与标识符

名称

英文别名：

N-[1-[2-methyl-6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl]isoquinoline-1-carboxamide;N-{1-[2-methyl-6-(trifluoromethyl)-4-pyrimidinyl]-4-piperidyl}-1-isoquinolinecarboxamide;N-(1-(2-methyl-6-(trifluoromethyl)pyrimidin-4-yl)piperidin-4-yl)isoquinoline-1-carboxamide;N-{1-[2-methyl-6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl}isoquinoline-1-carboxamide;

标识符

InChIKey：

MZZVXCMFXRZWNS-UHFFFAOYSA-N

Inchi：

1S/C21H20F3N5O/c1-13-26-17(21(22,23)24)12-18(27-13)29-10-7-15(8-11-29)28-20(30)19-16-5-3-2-4-14(16)6-9-25-19/h2-6,9,12,15H,7-8,10-11H2,1H3,(H,28,30)

SMILES：

FC(C1=C([H])C(=NC(C([H])([H])[H])=N1)N1C([H])([H])C([H])([H])C([H])(C([H])([H])C1([H])[H])N([H])C(C1C2=C([H])C([H])=C([H])C([H])=C2C([H])=C([H])N=1)=O)(F)F

N-{1-[2-methyl-6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl}isoquinoline-1-carboxamide(1775384-52-5)物化性质

计算特性

氢键供体数量 : 1
氢键受体数量 : 8
可旋转化学键数量 : 3
重原子数量 : 30
复杂度 : 596
疏水参数计算参考值（XlogP） : 4
拓扑分子极性表面积 : 71

791780-06-8(3-(3,4-二氯苯氧基)吖丁啶) 791778-53-5(trans-4-[2-[4-(2,3-Dichlorophenyl)piperazin-1-yl]ethyl]cyclohexanamine) 79201-37-9(4-N-叔丁氧羰基-4-N-甲基氨基哌啶) 787564-37-8((3R)-3-fluoropiperidine;hydrochloride) 78784-70-0(3-CHLORO-6-(2-PYRIDINYLMETHYL)PYRIDAZINE) 78789-65-8(butyl 3-(trichlorostannyl)propanoate compound with 2,2'-bipyridine (1:1) (en)) 792913-82-7((8-甲基-1,4-二氧杂螺[4.5]癸烷-8-基)氨基甲酸叔丁酯) 79324-78-0(1-(3-溴-4-(甲基硫代)苯基)乙酮)

960化工网为您提供N-{1-[2-methyl-6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl}isoquinoline-1-carboxamide专业化合物百科信息，包括中文名，英文名，分子式，分子量，以及该化合物的CasNo.1775384-52-5,相关理化性质;并提供了优质生产厂家信息包括厂家名称和联系方式等。 WAP版:1775384-52-5 国际站:1775384-52-5

1775384-52-5 ((N-{1-[2-methyl-6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl}isoquinoline-1-carboxamide)

N-{1-[2-methyl-6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl}isoquinoline-1-carboxamide(1775384-52-5)名称与标识符

名称

标识符

N-{1-[2-methyl-6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl}isoquinoline-1-carboxamide(1775384-52-5)物化性质

计算特性

目录