7-[4-[(2-bromo-4-methylphenyl)carbamothioyl]piperazin-1-yl]-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylic acid
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![7-[4-[(2-bromo-4-methylphenyl)carbamothioyl]piperazin-1-yl]-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/b5c2302fd75a48448e18304d94d20cc6.png "7-[4-[(2-bromo-4-methylphenyl)carbamothioyl]piperazin-1-yl]-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylic acid")
7-[4-[(2-bromo-4-methylphenyl)carbamothioyl]piperazin-1-yl]-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylic acid
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CAS No:
489463-07-2
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Formula:
C24H24BrFN4O3S
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Chemical Name:
7-[4-[(2-bromo-4-methylphenyl)carbamothioyl]piperazin-1-yl]-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylic acid
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Synonyms:
C24H24BrFN4O3S;SCHEMBL15281374;ZINC2280327;STK542743;AKOS001491062;MCULE-7649649776;489463-07-2;7-(4-{[(2-bromo-4-methylphenyl)amino]carbonothioyl}piperazin-1-yl)-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid;7-{4-[(2-bromo-4-methylphenyl)carbamothioyl]piperazin-1-yl}-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
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CAS No:
7-[4-[(2-bromo-4-methylphenyl)carbamothioyl]piperazin-1-yl]-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Basic Attributes
547.4 g/mol
546.07365 g/mol
Computed Properties
Molecular Weight:547.4
XLogP3:4.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:546.07365
Monoisotopic Mass:546.07365
Topological Polar Surface Area:108
Heavy Atom Count:34
Complexity:837
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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