1-ethyl-6-fluoro-7-[4-[(4-fluorobenzoyl)carbamothioyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid
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![1-ethyl-6-fluoro-7-[4-[(4-fluorobenzoyl)carbamothioyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/0fea649215e844878e190a26035d5c7f.png "1-ethyl-6-fluoro-7-[4-[(4-fluorobenzoyl)carbamothioyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid")
1-ethyl-6-fluoro-7-[4-[(4-fluorobenzoyl)carbamothioyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid
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CAS No:
496773-94-5
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Formula:
C24H22F2N4O4S
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Chemical Name:
1-ethyl-6-fluoro-7-[4-[(4-fluorobenzoyl)carbamothioyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid
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Synonyms:
MLS000777983;SMR000414377;1-Ethyl-6-fluoro-7-[4-(4-fluoro-benzoylaminocarbothioyl)-piperazin-1-yl]-4-oxo-1,4-dihydro-quinoline-3-c arboxylic acid;CHEMBL1464731;BDBM95034;cid_1920133;HMS2757A18;ZINC2300761;STK328904;AKOS005437456;MCULE-4358243534;1-ethyl-6-fluoro-7-[4-[(4-fluorobenzoyl)carbamothioyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid;1-ethyl-6-fluoranyl-7-[4-[(4-fluorophenyl)carbonylcarbamothioyl]piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid;1-ethyl-6-fluoro-7-(4-{[(4-fluorophenyl)carbonyl]carbamothioyl}piperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid;1-ethyl-6-fluoro-7-[4-[(4-fluorobenzoyl)thiocarbamoyl]piperazino]-4-keto-quinoline-3-carboxylic acid;1-ethyl-6-fluoro-7-[4-[[[(4-fluorophenyl)-oxomethyl]amino]-sulfanylidenemethyl]-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid;496773-94-5
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CAS No:
1-ethyl-6-fluoro-7-[4-[(4-fluorobenzoyl)carbamothioyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Basic Attributes
500.5 g/mol
500.13298269 g/mol
Computed Properties
Molecular Weight:500.5
XLogP3:3.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:4
Exact Mass:500.13298269
Monoisotopic Mass:500.13298269
Topological Polar Surface Area:125
Heavy Atom Count:35
Complexity:887
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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