4-[(4-methyl-4-oxidopiperazin-4-ium-1-yl)methyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide


Chemical Name: 4-[(4-methyl-4-oxidopiperazin-4-ium-1-yl)methyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide
CAS Number: 571186-91-9
Product Number: AG00EF22(AGN-PC-00PUOI)
Synonyms:
MDL No:
Molecular Formula: C29H31N7O2
Molecular Weight: 509.60214

Identification/Properties


Properties
MP:
146-149°C
Storage:
Keep in dry area;-10 ℃;Inert atmosphere;
Form:
Solid
Computed Properties
Molecular Weight:
509.614g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
7
Exact Mass:
509.254g/mol
Monoisotopic Mass:
509.254g/mol
Topological Polar Surface Area:
101A^2
Heavy Atom Count:
38
Formal Charge:
0
Complexity:
753
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

Safety Information


NMR Spectrum


Other Analytical Data


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