HCID58864319

(R)-3-[2-Methyl-1-(2-trimethylsilanyl-ethanesulfonyl)-1H-benzoimidazol-5-yl]-2-{[4-(2-oxo-1,4-dihydro-2H-quinazolin-3-yl)-piperidine-1-carbonyl]-amino}-propionic acid methyl ester

methyl (2R)-3-[2-methyl-1-(2-trimethylsilylethylsulfonyl)benzimidazol-5-yl]-2-[[4-(2-oxo-1,4-dihydroquinazolin-3-yl)piperidine-1-carbonyl]amino]propanoate

C31H42N6O6SSi654.9 g/mol

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IDENTITY

结构与身份

标准SMILES: COC(=O)[C@@H](Cc1ccc2c(c1)nc(C)n2S(=O)(=O)CC[Si](C)(C)C)NC(=O)N1CCC(N2Cc3ccccc3NC2=O)CC1
InChIKey: OPKSWHVGSNNYEU-HHHXNRCGSA-N
分子式: C31H42N6O6SSi
平均分子量: 654.9 g/mol
单同位素质量: 654.26558079

COMPUTED

结构计算性质

已同步

极性表面积: 151 Å²
氢键供体: 2
氢键受体: 7
可旋转键: 10
重原子: 45
形式电荷: 0
复杂度: 1,190

ALIASES

名称与别名

共 4 条

SCHEMBL3606492OPKSWHVGSNNYEU-HHHXNRCGSA-N(R)-3-[2-Methyl-1-(2-trimethylsilanyl -ethanesulfonyl)-1H-benzoimidazol-5-yl]-2-{[4-(2-oxo-1,4-dihydro-2H -quinazolin-3-yl)-piperidine-1-carbonyl]-amino}-propionic acid methyl ester(R)-3-[2-Methyl-1-(2-trimethylsilanyl-ethanesulfonyl)-1H-benzoimidazol-5-yl]-2-{[4-(2-oxo-1,4-dihydro-2H-quinazolin-3-yl)-piperidine-1-carbonyl]-amino}-propionic acid methyl ester

REACTIONS