7H-Pyrido[1,2,3-de]-1,4-benzoxazine-6-carboxylic acid,9-fluoro-2,3-dihydro-3-methyl-10-(4-methyl-1-piperazinyl)-7-oxo-,hydrate (2:1), (3S)-


Chemical Name: 7H-Pyrido[1,2,3-de]-1,4-benzoxazine-6-carboxylic acid,9-fluoro-2,3-dihydro-3-methyl-10-(4-methyl-1-piperazinyl)-7-oxo-,hydrate (2:1), (3S)-
CAS Number: 138199-71-0
Product Number: AG00189D(AGN-PC-0PMC1X)
Synonyms:
MDL No:
Molecular Formula: C36H42F2N6O9
Molecular Weight: 740.7503

Identification/Properties


Computed Properties
Molecular Weight:
740.762g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
17
Rotatable Bond Count:
4
Exact Mass:
740.298g/mol
Monoisotopic Mass:
740.298g/mol
Topological Polar Surface Area:
148A^2
Heavy Atom Count:
53
Formal Charge:
0
Complexity:
634
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:
3
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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