HCID57591093

2-chloro-9-methoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one

2-chloro-9-methoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one

C13H11ClN2O2262.69 g/mol

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IDENTITY

结构与身份

标准SMILES: COc1ccc2c(c1)CCn1c-2cc(Cl)nc1=O
InChIKey: NXMYLLIQRKHHHH-UHFFFAOYSA-N
分子式: C13H11ClN2O2
平均分子量: 262.69 g/mol
单同位素质量: 262.0509053

COMPUTED

结构计算性质

等待补全

XLogP: 2.2
极性表面积: 41.9 Å²
氢键供体: 0
氢键受体: 2
可旋转键: 1
重原子: 18
形式电荷: 0
复杂度: 433

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 6 条

2-chloro-9-methoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one830358-49-12-chloro-9-methoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-oneSCHEMBL875194NXMYLLIQRKHHHH-UHFFFAOYSA-N2-chloro-9-methoxy-6,7-dihydro-pyrimido[6,1-a]isoquinolin-4-one

REACTIONS

参与反应

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

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Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D

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