1-(2,4-difluoro-3-methylphenyl)-7-(3,5-dimethylpiperazin-1-yl)-6-fluoro-4-oxoquinoline-3-carboxylic acid
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1-(2,4-difluoro-3-methylphenyl)-7-(3,5-dimethylpiperazin-1-yl)-6-fluoro-4-oxoquinoline-3-carboxylic acid
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CAS No:
164662-52-6
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Formula:
C23H22F3N3O3
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Chemical Name:
1-(2,4-difluoro-3-methylphenyl)-7-(3,5-dimethylpiperazin-1-yl)-6-fluoro-4-oxoquinoline-3-carboxylic acid
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Synonyms:
PD161546;PD 161546;164662-52-6;3-Quinolinecarboxylic acid, 1-(2,4-difluoro-3-methylphenyl)-7-(3,5-dimethyl-1-piperazinyl)-6-fluoro-1,4-dihydro-4-oxo-;CHEMBL100920;DTXSID40936975;1-(2,4-difluoro-3-methyl-phenyl)-7-(3,5-dimethylpiperazin-1-yl)-6-fluoro-4-oxo-quinoline-3-carboxylic acid;1-(2,4-Difluoro-3-methylphenyl)-6-fluoro-7-(3,5-dimethyl-1-piperazinyl)-1,4-dihydro-4-oxoquinoline-3-carboxylic acid;1-(2,4-Difluoro-3-methylphenyl)-7-(3,5-dimethylpiperazin-1-yl)-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
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CAS No:
1-(2,4-difluoro-3-methylphenyl)-7-(3,5-dimethylpiperazin-1-yl)-6-fluoro-4-oxoquinoline-3-carboxylic acid Basic Attributes
445.4 g/mol
445.16132606 g/mol
Computed Properties
Molecular Weight:445.4
XLogP3:2.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:3
Exact Mass:445.16132606
Monoisotopic Mass:445.16132606
Topological Polar Surface Area:72.9
Heavy Atom Count:32
Complexity:771
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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