3-Quinolinecarboxylic acid,1-cyclopropyl-6-fluoro-1,4-dihydro-7-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]hept-2-yl]-4-oxo-


Chemical Name: 3-Quinolinecarboxylic acid,1-cyclopropyl-6-fluoro-1,4-dihydro-7-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]hept-2-yl]-4-oxo-
CAS Number: 112398-08-0
Product Number: AG0082O0(AGN-PC-0P3E3Q)
Synonyms:
MDL No:
Molecular Formula: C19H20FN3O3
Molecular Weight: 357.3788

Identification/Properties


Computed Properties
Molecular Weight:
357.385g/mol
XLogP3:
-0.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
3
Exact Mass:
357.149g/mol
Monoisotopic Mass:
357.149g/mol
Topological Polar Surface Area:
64.1A^2
Heavy Atom Count:
26
Formal Charge:
0
Complexity:
679
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
2811
Hazard Statements:
H319-H373-H412
Precautionary Statements:
P264-P280-P260-P273-P305+P351+P338-P337+P313-P314-P501
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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