HCID484324

2-(3,5-Diacetylphenyl)amino-4,6-diamino-1,3,5-triazine

1-[3-acetyl-5-[(4,6-diamino-1,3,5-triazin-2-yl)amino]phenyl]ethanone

C13H14N6O2286.29 g/molCAS 180741-01-9

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IDENTITY

结构与身份

标准SMILES: CC(=O)c1cc(Nc2nc(N)nc(N)n2)cc(C(C)=O)c1
InChIKey: XDWNZEIQFVEAOU-UHFFFAOYSA-N
分子式: C13H14N6O2
平均分子量: 286.29 g/mol
单同位素质量: 286.11782371

COMPUTED

结构计算性质

等待补全

XLogP: 0.5
极性表面积: 137 Å²
氢键供体: 3
氢键受体: 8
可旋转键: 4
重原子: 21
形式电荷: 0
复杂度: 372

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 10 条

180741-01-92-(3,5-Diacetylphenyl)amino-4,6-diamino-1,3,5-triazine1,1'-(5-((4,6-Diamino-1,3,5-triazin-2-yl)amino)-1,3-phenylene)diethanoneEthanone, 1,1'-(5-((4,6-diamino-1,3,5-triazin-2-yl)amino)-1,3-phenylene)bis-Ethanone, 1,1'-[5-[(4,6-diamino-1,3,5-triazin-2-yl)amino]-1,3-phenylene]bis-SCHEMBL3501609DTXSID00171007XDWNZEIQFVEAOU-UHFFFAOYSA-N1-[3-acetyl-5-[(4,6-diamino-1,3,5-triazin-2-yl)amino]phenyl]ethanone1,1'-{5-[(4,6-Diamino-1,3,5-triazin-2-yl)amino]-1,3-phenylene}di(ethan-1-one)

REACTIONS