1-ethyl-6-fluoro-7-[4-[(4-methoxycarbonylphenyl)carbamothioyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid
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![1-ethyl-6-fluoro-7-[4-[(4-methoxycarbonylphenyl)carbamothioyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/528cdc54af1b42a2bba3725676a5a624.png "1-ethyl-6-fluoro-7-[4-[(4-methoxycarbonylphenyl)carbamothioyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid")
1-ethyl-6-fluoro-7-[4-[(4-methoxycarbonylphenyl)carbamothioyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid
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CAS No:
488093-68-1
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Formula:
C25H25FN4O5S
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Chemical Name:
1-ethyl-6-fluoro-7-[4-[(4-methoxycarbonylphenyl)carbamothioyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid
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Synonyms:
ZINC2325979;STK544692;AKOS001491075;MCULE-3947637164;1-ethyl-6-fluoro-7-(4-{[4-(methoxycarbonyl)phenyl]carbamothioyl}piperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid;1-ethyl-6-fluoro-7-[4-({[4-(methoxycarbonyl)phenyl]amino}carbonothioyl)piperazin-1-yl]-4-oxo-1,4-dihydroquinoline-3-carboxylic acid;488093-68-1
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CAS No:
1-ethyl-6-fluoro-7-[4-[(4-methoxycarbonylphenyl)carbamothioyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Basic Attributes
512.6 g/mol
512.15296925 g/mol
Computed Properties
Molecular Weight:512.6
XLogP3:3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:6
Exact Mass:512.15296925
Monoisotopic Mass:512.15296925
Topological Polar Surface Area:135
Heavy Atom Count:36
Complexity:901
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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