1-ethyl-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid;pyridine-3-carboxylic acid


Chemical Name: 1-ethyl-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid;pyridine-3-carboxylic acid
CAS Number: 118803-81-9
Product Number: AG007PKJ(AGN-PC-0JLUTH)
Synonyms:
MDL No: MFCD00873666
Molecular Formula: C22H23FN4O5
Molecular Weight: 442.4402

Identification/Properties


Computed Properties
Molecular Weight:
442.447g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
10
Rotatable Bond Count:
4
Exact Mass:
442.165g/mol
Monoisotopic Mass:
442.165g/mol
Topological Polar Surface Area:
123A^2
Heavy Atom Count:
32
Formal Charge:
0
Complexity:
632
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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