HCID68657947

{2-(4-Hydroxy-phenyl)-1-[1-methylcarbamoyl-2-(4-nitro-phenyl)-ethylcarbamoyl]-ethyl} carbamic acid tert-butyl ester

tert-butyl N-[3-(4-hydroxyphenyl)-1-[[1-(methylamino)-3-(4-nitrophenyl)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]carbamate

C24H30N4O7486.5 g/mol

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IDENTITY

结构与身份

标准SMILES: CNC(=O)C(Cc1ccc([N+](=O)[O-])cc1)NC(=O)C(Cc1ccc(O)cc1)NC(=O)OC(C)(C)C
InChIKey: FIYAZAORNPNXHJ-UHFFFAOYSA-N
分子式: C24H30N4O7
平均分子量: 486.5 g/mol
单同位素质量: 486.21144931

COMPUTED

结构计算性质

已同步

XLogP: 2.4
极性表面积: 163 Å²
氢键供体: 4
氢键受体: 7
可旋转键: 10
重原子: 35
形式电荷: 0
复杂度: 733

ALIASES

名称与别名

共 5 条

SCHEMBL3477645FIYAZAORNPNXHJ-UHFFFAOYSA-N{2-(4-Hydroxy-phenyl)-1-[1-methylcarbamoyl-2-(4-nitro-phenyl)-ethylcarbamoyl]-ethyl} carbamic acid tert-butyl ester{2-(4-Hydroxy-phenyl)-1-[1-methylcarbamoyl-2-(4-nitro-phenyl)-ethylcarbamoyl]-ethyl}carbamic acid tert-butyl ester{2-(4-Hydroxy-phenyl)-1-[1-methylcarbamoyl-2-(4-nitro-phenyl)-ethylcarbamoyl]ethyl} carbamic acid tert-butyl ester

REACTIONS