HCID57428872

2-(5-Bromo-2-chloropyrimidin-4-yl)thieno[2,3-c]pyridine

C11H5BrClN3S326.6 g/mol

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IDENTITY

结构与身份

标准SMILES: Clc1ncc(Br)c(-c2cc3ccncc3s2)n1
InChIKey: BVJSDWADGQHLEW-UHFFFAOYSA-N
分子式: C11H5BrClN3S
平均分子量: 326.6 g/mol
单同位素质量: 324.90761

COMPUTED

结构计算性质

已同步

XLogP: 3.5
极性表面积: 66.9 Å²
氢键供体: 0
氢键受体: 4
可旋转键: 1
重原子: 17
形式电荷: 0
复杂度: 283

ALIASES

名称与别名

共 6 条

893442-36-9SCHEMBL2985245BVJSDWADGQHLEW-UHFFFAOYSA-NDB-2022512-(5-Bromo-2-chloro-4-pyrimidinyl)-thieno[2,3-c]pyridine2-(5-bromo-2-chloropyrimidin-4-yl)thieno[2,3-c]pyridine

REACTIONS

参与反应

6 条

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D

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uspto-grants-2010_08 · 10.6084/m9.figshare.5104873.v1 · US07786132B2

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uspto-grants-2010_08 · 10.6084/m9.figshare.5104873.v1 · US07786132B2

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uspto-grants-2010_12 · 10.6084/m9.figshare.5104873.v1 · US07858785B2

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uspto-grants-2010_12 · 10.6084/m9.figshare.5104873.v1 · US07858785B2

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