HCID66868514

methyl 4-(N-(2-(tert-butyldimethylsilyloxy)ethyl)-10-methyl-4,5-dihydrobenzo[b]thieno[2,3-d]oxepine-2-carboxamido)-3-chlorobenzoate

methyl 4-[2-[tert-butyl(dimethyl)silyl]oxyethyl-(10-methyl-4,5-dihydrothieno[3,2-d][1]benzoxepine-2-carbonyl)amino]-3-chlorobenzoate

C30H36ClNO5SSi586.2 g/mol

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IDENTITY

结构与身份

标准SMILES: COC(=O)c1ccc(N(CCO[Si](C)(C)C(C)(C)C)C(=O)c2cc3c(s2)-c2c(C)cccc2OCC3)c(Cl)c1
InChIKey: NKLYONZKLKJFOR-UHFFFAOYSA-N
分子式: C30H36ClNO5SSi
平均分子量: 586.2 g/mol
单同位素质量: 585.1771987

COMPUTED

结构计算性质

已同步

极性表面积: 93.3 Å²
氢键供体: 0
氢键受体: 6
可旋转键: 9
重原子: 39
形式电荷: 0
复杂度: 869

ALIASES

名称与别名

共 3 条

SCHEMBL988362NKLYONZKLKJFOR-UHFFFAOYSA-Nmethyl 4-(N-(2-(tert-butyldimethylsilyloxy)ethyl)-10-methyl-4,5-dihydrobenzo[b]thieno[2,3-d]oxepine-2-carboxamido)-3-chlorobenzoate

REACTIONS