HCID90041450

4-(4-(2-(((3R,3aR,6R,6aS)-6-((tert-butyldimethylsilyl)oxy)hexahydrofuro[3,2-b]furan-3-yl)oxy)-6-chloro-1-((2-(trimethylsilyl)ethoxy)methyl)-1H-imidazo[4,5-b]pyridin-5-yl)phenyl)-3,6-dihydro-2H-thiopyran 1,1-dioxide

2-[[2-[[(3R,3aR,6R,6aS)-6-[tert-butyl(dimethyl)silyl]oxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]oxy]-6-chloro-5-[4-(1,1-dioxo-3,6-dihydro-2H-thiopyran-4-yl)phenyl]imidazo[4,5-b]pyridin-1-yl]methoxy]ethyl-trimethylsilane

C35H50ClN3O7SSi2748.5 g/mol

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IDENTITY

结构与身份

标准SMILES: CC(C)(C)[Si](C)(C)O[C@@H]1CO[C@H]2[C@@H]1OC[C@H]2Oc1nc2nc(-c3ccc(C4=CCS(=O)(=O)CC4)cc3)c(Cl)cc2n1COCC[Si](C)(C)C
InChIKey: GNOFKSODDTWNGL-DHPILJFKSA-N
分子式: C35H50ClN3O7SSi2
平均分子量: 748.5 g/mol
单同位素质量: 747.2596529

COMPUTED

结构计算性质

已同步

极性表面积: 119 Å²
氢键供体: 0
氢键受体: 9
可旋转键: 12
重原子: 49
形式电荷: 0
复杂度: 1,280

ALIASES

名称与别名

共 3 条

SCHEMBL15570189GNOFKSODDTWNGL-DHPILJFKSA-N4-(4-(2-(((3R,3aR,6R,6aS)-6-((tert-butyldimethylsilyl)oxy)hexahydrofuro[3,2-b]furan-3-yl)oxy)-6-chloro-1-((2-(trimethylsilyl)ethoxy)methyl)-1H-imidazo[4,5-b]pyridin-5-yl)phenyl)-3,6-dihydro-2H-thiopyran 1,1-dioxide

REACTIONS

参与反应

1 条

uspto-grants-2016_03 · 10.6084/m9.figshare.5104873.v1 · US09290517B2

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