7-Bromo-1-cyclopropyl-6-fluoro-5-methyl-4-oxo-1,4-dihydroquinoline-3-carboxylic acid 分子结构式
HCID10132015

7-Bromo-1-cyclopropyl-6-fluoro-5-methyl-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

7-bromo-1-cyclopropyl-6-fluoro-5-methyl-4-oxoquinoline-3-carboxylic acid

C14H11BrFNO3340.14 g/molCAS 119916-34-6

IDENTITY

结构与身份

标准SMILES
Cc1c(F)c(Br)cc2c1c(=O)c(C(=O)O)cn2C1CC1
InChIKey
FMNWEXUSEYKPGZ-UHFFFAOYSA-N
分子式
C14H11BrFNO3
平均分子量
340.14 g/mol
单同位素质量
338.99063

COMPUTED

结构计算性质

已同步
XLogP
3.7
极性表面积
57.6 Ų
氢键供体
1
氢键受体
5
可旋转键
2
重原子
20
形式电荷
0
复杂度
491

ALIASES

名称与别名

共 9 条
119916-34-67-BROMO-1-CYCLOPROPYL-6-FLUORO-5-METHYL-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXYLIC ACIDFMNWEXUSEYKPGZ-UHFFFAOYSA-N7-BROMO-1-CYCLOPROPYL-6-FLUORO-5-METHYL-4-OXOQUINOLINE-3-CARBOXYLIC ACIDSCHEMBL5868703DTXSID704360741-cyclopropyl-6-fluoro-7-bromo-5-methyl-1,4- dihydro-4-oxoquinoline-3-carboxylic acid1-cyclopropyl-6-fluoro-7-bromo-5-methyl-1,4-dihydro-4-oxoquinoline-3-carboxylic acid7-Bromo-1-Cyclopropyl-6-Fluoro-5-Methyl-4-Oxo-1,4-Dihydro-3-Quinolinecarboxylic Acid

REACTIONS

相关反应

12
HRID 1288 反应方程式

uspto-grants-1998_03 · 10.6084/m9.figshare.5104873.v1 · US05723648

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HRID 1295 反应方程式

uspto-grants-1998_03 · 10.6084/m9.figshare.5104873.v1 · US05723648

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HRID 137824 反应方程式

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

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HRID 486269 反应方程式

uspto-grants-1994_03 · 10.6084/m9.figshare.5104873.v1 · US05290934

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HRID 486275 反应方程式

uspto-grants-1994_03 · 10.6084/m9.figshare.5104873.v1 · US05290934

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HRID 663294 反应方程式

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

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HRID 864344 反应方程式

uspto-grants-1996_10 · 10.6084/m9.figshare.5104873.v1 · US05563138

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HRID 864351 反应方程式

uspto-grants-1996_10 · 10.6084/m9.figshare.5104873.v1 · US05563138

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