HCID457469

2,2'-Dithiobis(N-(3-(trifluoromethyl)phenyl)benzamide)

N-[3-(trifluoromethyl)phenyl]-2-[[2-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]disulfanyl]benzamide

C28H18F6N2O2S2592.6 g/molCAS 96835-63-1

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IDENTITY

结构与身份

标准SMILES: O=C(Nc1cccc(C(F)(F)F)c1)c1ccccc1SSc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1
InChIKey: WHSBVRBPSIYEHO-UHFFFAOYSA-N
分子式: C28H18F6N2O2S2
平均分子量: 592.6 g/mol
单同位素质量: 592.07138914

COMPUTED

结构计算性质

已同步

XLogP: 7.5
极性表面积: 109 Å²
氢键供体: 2
氢键受体: 10
可旋转键: 7
重原子: 40
形式电荷: 0
复杂度: 790

ALIASES

名称与别名

共 8 条

96835-63-12,2'-Dithiobis(N-(3-(trifluoromethyl)phenyl)benzamide)2,2'-Dithiobis[N-[3-(trifluoromethyl)phenyl]benzamide]N-[3-(trifluoromethyl)phenyl]-2-[[2-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]disulfanyl]benzamideCHEMBL296929SCHEMBL8376204DTXSID802425822,2'-Disulfanediylbis{N-[3-(trifluoromethyl)phenyl]benzamide}

REACTIONS

参与反应

3 条

uspto-grants-1998_03 · 10.6084/m9.figshare.5104873.v1 · US05734081

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uspto-grants-1999_07 · 10.6084/m9.figshare.5104873.v1 · US05929114

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uspto-grants-1997_09 · 10.6084/m9.figshare.5104873.v1 · US05668291

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