4-[[2,6-difluoro-4-[3-(1-piperidin-4-ylpyrazol-4-yl)quinoxalin-5-yl]phenyl]methyl]morpholine;dihydrochloride


Chemical Name: 4-[[2,6-difluoro-4-[3-(1-piperidin-4-ylpyrazol-4-yl)quinoxalin-5-yl]phenyl]methyl]morpholine;dihydrochloride
CAS Number: 1092499-93-8
Product Number: AG008TIL(AGN-PC-0BS2BC)
Synonyms:
MDL No:
Molecular Formula: C27H28F2N6O
Molecular Weight: 490.5476

Identification/Properties


Computed Properties
Molecular Weight:
490.5g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
5
Exact Mass:
490.229266g/mol
Monoisotopic Mass:
490.229266g/mol
Topological Polar Surface Area:
68.1Ų
Heavy Atom Count:
36
Formal Charge:
0
Complexity:
696
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:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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