HCID3069130

5H-Thiazolo(3,2-a)quinoline-4-carboxylic acid, 7-fluoro-5-oxo-8-(1-piperazinyl)-

7-fluoro-5-oxo-8-piperazin-1-yl-[1,3]thiazolo[3,2-a]quinoline-4-carboxylic acid

C16H14FN3O3S347.4 g/molCAS 84338-99-8

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IDENTITY

结构与身份

标准SMILES: O=C(O)c1c(=O)c2cc(F)c(N3CCNCC3)cc2n2ccsc12
InChIKey: LJWAKCLLEGXTCW-UHFFFAOYSA-N
分子式: C16H14FN3O3S
平均分子量: 347.4 g/mol
单同位素质量: 347.07399065

COMPUTED

结构计算性质

等待补全

XLogP: -0.2
极性表面积: 98.2 Å²
氢键供体: 2
氢键受体: 8
可旋转键: 2
重原子: 24
形式电荷: 0
复杂度: 632

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 9 条

84338-99-85H-Thiazolo(3,2-a)quinoline-4-carboxylic acid, 7-fluoro-5-oxo-8-(1-piperazinyl)-7-Fluoro-5-oxo-8-(1-piperazinyl)-5H-thiazolo(3,2-a)quinoline-4-carboxylic acidDTXSID40233299RefChem:305889DTXCID90155790CHEMBL28129SCHEMBL107427107-FLUORO-5-OXO-8-(PIPERAZIN-1-YL)-5H-[1,3]THIAZOLO[3,2-A]QUINOLINE-4-CARBOXYLIC ACID

REACTIONS

参与反应

7 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 (2/10) · 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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Test data from https://doi.org/10.1039/C8SC04228D · 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 (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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