L-Aspartic acid,1-ethyl-6,8-difluoro-1,4-dihydro-7-(3-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylateOTHER CA INDEX NAMES:3-Quinolinecarboxylic acid,1-ethyl-6,8-difluoro-1,3-dihydro-7-(3-methyl-1-piperazinyl)-4-oxo-,L-aspartate (1:1)


Chemical Name: L-Aspartic acid,1-ethyl-6,8-difluoro-1,4-dihydro-7-(3-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylateOTHER CA INDEX NAMES:3-Quinolinecarboxylic acid,1-ethyl-6,8-difluoro-1,3-dihydro-7-(3-methyl-1-piperazinyl)-4-oxo-,L-aspartate (1:1)
CAS Number: 211690-33-4
Product Number: AG006YV9(AGN-PC-0QXQ4X)
Synonyms:
MDL No:
Molecular Formula: C21H26F2N4O7
Molecular Weight: 484.4505

Identification/Properties


Computed Properties
Molecular Weight:
484.457g/mol
Hydrogen Bond Donor Count:
5
Hydrogen Bond Acceptor Count:
13
Rotatable Bond Count:
6
Exact Mass:
484.177g/mol
Monoisotopic Mass:
484.177g/mol
Topological Polar Surface Area:
174A^2
Heavy Atom Count:
34
Formal Charge:
0
Complexity:
718
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H317-H319
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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