HCID59398071

tert-butyl (2,3-dihydro-1,4-benzodioxin-6-ylmethyl)(1-(2-(4-methyl-7-((methylamino) carbonyl)-2-oxoquinolin-1(2H)-yl)ethyl)piperidin-4-yl)carbamate

tert-butyl N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-[1-[2-[4-methyl-7-(methylcarbamoyl)-2-oxoquinolin-1-yl]ethyl]piperidin-4-yl]carbamate

C33H42N4O6590.7 g/mol

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IDENTITY

结构与身份

标准SMILES: CNC(=O)c1ccc2c(C)cc(=O)n(CCN3CCC(N(Cc4ccc5c(c4)OCCO5)C(=O)OC(C)(C)C)CC3)c2c1
InChIKey: WGGOSUGBZTWNRH-UHFFFAOYSA-N
分子式: C33H42N4O6
平均分子量: 590.7 g/mol
单同位素质量: 590.31043507

COMPUTED

结构计算性质

已同步

XLogP: 3.4
极性表面积: 101 Å²
氢键供体: 1
氢键受体: 7
可旋转键: 9
重原子: 43
形式电荷: 0
复杂度: 1,030

ALIASES

名称与别名

共 5 条

SCHEMBL2797884WGGOSUGBZTWNRH-UHFFFAOYSA-Ntert-butyl (2,3-dihydro-1,4-benzodioxin-6-ylmethyl)(1-(2-(4-methyl-7-((methylamino) carbonyl)-2-oxoquinolin-1(2H)-yl)ethyl)piperidin-4-yl)carbamatetert-butyl(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)(1-(2-(4-methyl-7-((methylamino)carbonyl)-2-oxo-1,2-dihydroquinolin-1-yl)ethyl)piperidin-4-yl)carbamatetert-butyl(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)(1-(2-(4-methyl-7-((methylamino)carbonyl)-2-oxoquinolin-1(2H)-yl)ethyl)piperidin-4-yl)carbamate

REACTIONS