4(3H)-Quinazolinone,5-fluoro-3-phenyl-2-[(1S)-1-(1H-purin-6-ylamino)propyl]-


Chemical Name: 4(3H)-Quinazolinone,5-fluoro-3-phenyl-2-[(1S)-1-(1H-purin-6-ylamino)propyl]-
CAS Number: 870281-82-6
Product Number: AG00GU21(AGN-PC-0VA02T)
Synonyms:
MDL No:
Molecular Formula: C22H18FN7O
Molecular Weight: 415.4230

Identification/Properties


Computed Properties
Molecular Weight:
415.432g/mol
XLogP3:
3.7
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
5
Exact Mass:
415.156g/mol
Monoisotopic Mass:
415.156g/mol
Topological Polar Surface Area:
99.2A^2
Heavy Atom Count:
31
Formal Charge:
0
Complexity:
685
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
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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