HCID76753191

{2-(4-Chloro-phenyl)-2-[6-(3-methyl-1-trityl-1H-pyrazol-4-yl)-pyridin-3-yl]-vinyl}-methyl-(1-phenyl-ethyl)-amine

2-(4-chlorophenyl)-N-methyl-2-[6-(3-methyl-1-tritylpyrazol-4-yl)-3-pyridinyl]-N-(1-phenylethyl)ethenamine

C45H39ClN4671.3 g/mol

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IDENTITY

结构与身份

标准 SMILES: Cc1nn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1-c1ccc(C(=CN(C)C(C)c2ccccc2)c2ccc(Cl)cc2)cn1
InChIKey: CNKMDQTUJJUOBH-UHFFFAOYSA-N
分子式: C45H39ClN4
平均分子量: 671.3 g/mol
单同位素质量: 670.286325

COMPUTED

结构计算性质

已同步

XLogP: 11
极性表面积: 34 Å²
氢键供体: 0
氢键受体: 3
可旋转键: 10
重原子: 50
形式电荷: 0
复杂度: 1,000

ALIASES

名称与别名

共 4 条

{2-(4-Chloro-phenyl)-2-[6-(3-methyl-1-trityl-1H-pyrazol-4-yl)-pyridin-3-yl]-vinyl}-methyl-(1-phenyl-ethyl)-amine{2-(4-Chloro-phenyl)-2-[6-(3-methyl-1-trityl-1H-pyrazol-4-yl]-pyridin-3-yl)-vinyl}-methyl-(1-phenyl-ethyl)-amineSCHEMBL1978748CNKMDQTUJJUOBH-UHFFFAOYSA-N

REACTIONS