HCID11276338

1-(4-Nitrophenyl)pyrimidine-2,4-dione

C10H7N3O4233.18 g/mol

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IDENTITY

结构与身份

标准SMILES: O=c1ccn(-c2ccc([N+](=O)[O-])cc2)c(=O)[nH]1
InChIKey: IUEJPGLGKJDIRU-UHFFFAOYSA-N
分子式: C10H7N3O4
平均分子量: 233.18 g/mol
单同位素质量: 233.04365571

COMPUTED

结构计算性质

已同步

XLogP: 0.6
极性表面积: 95.2 Å²
氢键供体: 1
氢键受体: 4
可旋转键: 1
重原子: 17
形式电荷: 0
复杂度: 380

ALIASES

名称与别名

共 14 条

1-(4-nitrophenyl)pyrimidine-2,4-dione125236-31-91-(4-Nitrophenyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione1-(4-Nitro-phenyl)-1H-pyrimidine-2,4-dione1-(4-nitrophenyl)-2,4(1H,3H)-pyrimidinedione1-(4-NITROPHENYL)PYRIMIDINE-2,4(1H,3H)-DIONESCHEMBL3370902IUEJPGLGKJDIRU-UHFFFAOYSA-NALBB-033452MFCD32175095AKOS040766465LS-12700DB-126603H46982

REACTIONS

参与反应

8 条

uspto-grants-2010_06 · 10.6084/m9.figshare.5104873.v1 · US07741341B2

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uspto-grants-2010_06 · 10.6084/m9.figshare.5104873.v1 · US07741341B2

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Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D

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

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uspto-grants-1990_06 · 10.6084/m9.figshare.5104873.v1 · US04931444

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uspto-grants-1990_06 · 10.6084/m9.figshare.5104873.v1 · US04931444

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