HCID693112

Isoquinolyl 4-methoxyphenyl ketone

isoquinolin-1-yl-(4-methoxyphenyl)methanone

C17H13NO2263.29 g/mol

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IDENTITY

结构与身份

标准SMILES: COc1ccc(C(=O)c2nccc3ccccc23)cc1
InChIKey: AEHSAUPWRMSRNX-UHFFFAOYSA-N
分子式: C17H13NO2
平均分子量: 263.29 g/mol
单同位素质量: 263.09462866

COMPUTED

结构计算性质

已同步

XLogP: 3.7
极性表面积: 39.2 Å²
氢键供体: 0
氢键受体: 3
可旋转键: 3
重原子: 20
形式电荷: 0
复杂度: 336

ALIASES

名称与别名

共 18 条

Oprea1_799084Oprea1_800642MLS000516298CHEMBL549291IFLab1_005087SCHEMBL1445542AEHSAUPWRMSRNX-UHFFFAOYSA-Nisoquinolyl 4-methoxyphenyl ketoneHMS1426H05HMS2708N151-Isoquinolyl(4-methoxyphenyl)ketoneAKOS000808019SMR000372949EU-0047376ST50037065SR-01000746439SR-01000746439-2Z56903975

REACTIONS