6-amino-1-benzyl-5-bromo-3-methylpyrimidine-2,4-dione


Chemical Name: 6-amino-1-benzyl-5-bromo-3-methylpyrimidine-2,4-dione
CAS Number: 610259-81-9
Product Number: AG00IASK(AGN-PC-0KFOF6)
Synonyms:
MDL No: MFCD03655935
Molecular Formula: C12H12BrN3O2
Molecular Weight: 310.1466

Identification/Properties


Computed Properties
Molecular Weight:
310.151g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
309.011g/mol
Monoisotopic Mass:
309.011g/mol
Topological Polar Surface Area:
66.6A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
402
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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