HCID17604973

[5-(4-Methoxyphenyl)-1,2,4-oxadiazol-3-yl]methanamine

C10H11N3O2205.21 g/mol

查看相关反应子结构检索查找相似结构

IDENTITY

结构与身份

标准SMILES: COc1ccc(-c2nc(CN)no2)cc1
InChIKey: TUFFXZLOCMNCIS-UHFFFAOYSA-N
分子式: C10H11N3O2
平均分子量: 205.21 g/mol
单同位素质量: 205.0851266

COMPUTED

结构计算性质

已同步

XLogP: 0.7
极性表面积: 74.2 Å²
氢键供体: 1
氢键受体: 5
可旋转键: 3
重原子: 15
形式电荷: 0
复杂度: 195

ALIASES

名称与别名

共 12 条

914810-86-9[5-(4-methoxyphenyl)-1,2,4-oxadiazol-3-yl]methanamine[5-(4-methoxyphenyl)-1,2,4-oxadiazol-3-yl]methylamine(5-(4-Methoxyphenyl)-1,2,4-oxadiazol-3-yl)methanamine[5-(4-Methoxyphenyl)-1,2,4-oxadiazol-3-yl]-methylamineSCHEMBL3579445TUFFXZLOCMNCIS-UHFFFAOYSA-NALBB-004172MFCD07364471AKOS005171327EN300-70556Z111583018

REACTIONS

参与反应

4 条

Training data from https://doi.org/10.1039/C8SC04228D (5/10) · 10.1039/C8SC04228D

查看

Training data from https://doi.org/10.1039/C8SC04228D (5/10) · 10.1039/C8SC04228D

查看

uspto-grants-2010_03 · 10.6084/m9.figshare.5104873.v1 · US07687623B2

查看

uspto-grants-2010_03 · 10.6084/m9.figshare.5104873.v1 · US07687623B2

查看