HCID178502203

{1-[4-(4-Bromo-phenyl)-1'-phenyl-1',2',4',5'-tetrahydro-1H-[2,4]biimidazolyl-3'-carbonyl]-2-methyl-propyl}-carbamic acid methyl ester

methyl N-[1-[5-[5-(4-bromophenyl)-1H-imidazol-2-yl]-3-phenylimidazolidin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamate

C25H28BrN5O3526.4 g/mol

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IDENTITY

结构与身份

标准SMILES: COC(=O)NC(C(=O)N1CN(c2ccccc2)CC1c1nc(-c2ccc(Br)cc2)c[nH]1)C(C)C
InChIKey: DWJKQIPYUXFQQL-UHFFFAOYSA-N
分子式: C25H28BrN5O3
平均分子量: 526.4 g/mol
单同位素质量: 525.13755

COMPUTED

结构计算性质

已同步

XLogP: 4.6
极性表面积: 90.6 Å²
氢键供体: 2
氢键受体: 5
可旋转键: 7
重原子: 34
形式电荷: 0
复杂度: 696

ALIASES

名称与别名

共 4 条

SCHEMBL205476DWJKQIPYUXFQQL-UHFFFAOYSA-N{1-[4-(4-Bromo-phenyl)-1'-phenyl-1',2',4',5'-tetrahydro-1H-[2,4']biimidazolyl-3'-carbonyl]-2-methyl-propyl}-carbamic acid methyl ester{1-[4-(4-Bromo-phenyl)-1'-phenyl-1',2',4',5'-tetrahydro-1H-[2,4]biimidazolyl-3'-carbonyl]-2-methyl-propyl}-carbamic acid methyl ester

REACTIONS