1,8-Naphthyridine-3-carboxylic acid,7-(6-amino-3-azabicyclo[3.1.0]hex-3-yl)-1-(2,4-difluorophenyl)-6-fluoro-1,4-dihydro-4-oxo-, (1a,5a,6a)-, monomethanesulfonate


Chemical Name: 1,8-Naphthyridine-3-carboxylic acid,7-(6-amino-3-azabicyclo[3.1.0]hex-3-yl)-1-(2,4-difluorophenyl)-6-fluoro-1,4-dihydro-4-oxo-, (1a,5a,6a)-, monomethanesulfonate
CAS Number: 147059-75-4
Product Number: AG001EKX(AGN-PC-0PZRAB)
Synonyms:
MDL No:
Molecular Formula: C20H15F3N4O3
Molecular Weight: 416.3533

Identification/Properties


Computed Properties
Molecular Weight:
512.46g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
13
Rotatable Bond Count:
3
Exact Mass:
512.098g/mol
Monoisotopic Mass:
512.098g/mol
Topological Polar Surface Area:
163A^2
Heavy Atom Count:
35
Formal Charge:
0
Complexity:
863
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:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
N/A
Hazard Statements:
-
Precautionary Statements:
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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