HCID178459022

Isopropyl 4-(1-hydroxy-1-methylethyl)-2-isopropoxymethyl-1-{4-[2-(tetrazol-5-yl)phenyl]phenyl}methylimidazole-5-carboxylate

propan-2-yl 5-(2-hydroxypropan-2-yl)-2-(propan-2-yloxymethyl)-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carboxylate

C28H34N6O4518.6 g/mol

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IDENTITY

结构与身份

标准SMILES: CC(C)OCc1nc(C(C)(C)O)c(C(=O)OC(C)C)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1
InChIKey: OJHUVVVDUYHMSK-UHFFFAOYSA-N
分子式: C28H34N6O4
平均分子量: 518.6 g/mol
单同位素质量: 518.26415359

COMPUTED

结构计算性质

已同步

XLogP: 3.7
极性表面积: 128 Å²
氢键供体: 2
氢键受体: 8
可旋转键: 11
重原子: 38
形式电荷: 0
复杂度: 760

ALIASES

名称与别名

共 3 条

SCHEMBL7878400OJHUVVVDUYHMSK-UHFFFAOYSA-NIsopropyl 4-(1-hydroxy-1-methylethyl)-2-isopropoxymethyl-1-{4-[2-(tetrazol-5-yl)phenyl]phenyl}methylimidazole-5-carboxylate

REACTIONS