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Home > Imidazoles > 16328-63-5
16328-63-5 | 2H-IMIDAZO[4,5-B]PYRAZIN-2-ONE, 1,3-DIHYDRO-
CAS No: 16328-63-5 Catalog No: AG001TZR MDL No:MFCD08669462
Product Description
Catalog Number:
AG001TZR
Chemical Name:
2H-IMIDAZO[4,5-B]PYRAZIN-2-ONE, 1,3-DIHYDRO-
CAS Number:
16328-63-5
Molecular Formula:
C5H4N4O
Molecular Weight:
136.1115
MDL Number:
MFCD08669462
IUPAC Name:
1,3-dihydroimidazo[4,5-b]pyrazin-2-one
InChI:
InChI=1S/C5H4N4O/c10-5-8-3-4(9-5)7-2-1-6-3/h1-2H,(H2,6,7,8,9,10)
InChI Key:
CGKLYWOFLUIKCX-UHFFFAOYSA-N
SMILES:
O=c1[nH]c2c([nH]1)nccn2
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.039g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
136.114g/mol
Monoisotopic Mass:
136.039g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9
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