HCID68508300

2-(biphenyl-4-ylmethyl)-3-chloro-7-isobutyl-5-methyl-2H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione

3-chloro-5-methyl-7-(2-methylpropyl)-2-[(4-phenylphenyl)methyl]pyrazolo[3,4-d]pyrimidine-4,6-dione

C23H23ClN4O2422.9 g/mol

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IDENTITY

结构与身份

标准SMILES: CC(C)Cn1c(=O)n(C)c(=O)c2c(Cl)n(Cc3ccc(-c4ccccc4)cc3)nc21
InChIKey: KTCBKPIVBFHPJG-UHFFFAOYSA-N
分子式: C23H23ClN4O2
平均分子量: 422.9 g/mol
单同位素质量: 422.1509537

COMPUTED

结构计算性质

等待补全

XLogP: 5
极性表面积: 58.4 Å²
氢键供体: 0
氢键受体: 3
可旋转键: 5
重原子: 30
形式电荷: 0
复杂度: 631

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 4 条

SCHEMBL3091849KTCBKPIVBFHPJG-UHFFFAOYSA-N2-(biphenyl-4-ylmethyl)-3 -chloro-7-isobutyl-5-methyl-2H-pyrazolo [3,4-d]pyrimidine-4,6(5H,7H)-dione2-(biphenyl-4-ylmethyl)-3-chloro-7-isobutyl-5-methyl-2H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione

REACTIONS

参与反应

1 条

uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08846693B2

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