HCID86707104

Tert-butyl 4-[6-[6-(5-amino-6-methyl-pyrazin-2-yl)pyrazolo[4,3-c]pyridin-1-yl]-2-pyridyl]-1,4-diazepane-1-carboxylate

tert-butyl 4-[6-[6-(5-amino-6-methylpyrazin-2-yl)pyrazolo[4,3-c]pyridin-1-yl]-2-pyridinyl]-1,4-diazepane-1-carboxylate

C26H31N9O2501.6 g/mol

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IDENTITY

结构与身份

标准SMILES: Cc1nc(-c2cc3c(cn2)cnn3-c2cccc(N3CCCN(C(=O)OC(C)(C)C)CC3)n2)cnc1N
InChIKey: JUDMWISBYWAETG-UHFFFAOYSA-N
分子式: C26H31N9O2
平均分子量: 501.6 g/mol
单同位素质量: 501.26007127

COMPUTED

结构计算性质

等待补全

XLogP: 2.5
极性表面积: 128 Å²
氢键供体: 1
氢键受体: 9
可旋转键: 5
重原子: 37
形式电荷: 0
复杂度: 780

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 3 条

SCHEMBL15401227JUDMWISBYWAETG-UHFFFAOYSA-Ntert-butyl 4-[6-[6-(5-amino-6-methyl-pyrazin-2-yl)pyrazolo[4,3-c]pyridin-1-yl]-2-pyridyl]-1,4-diazepane-1-carboxylate

REACTIONS