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14630-99-0 | Imidazo[1,2-c]pyrimidine-2,5(3H,6H)-dione
CAS No: 14630-99-0 Catalog No: AG001DVE MDL No:
Product Description
Catalog Number:
AG001DVE
Chemical Name:
Imidazo[1,2-c]pyrimidine-2,5(3H,6H)-dione
CAS Number:
14630-99-0
Molecular Formula:
C6H5N3O2
Molecular Weight:
151.1228
IUPAC Name:
1,3-dihydroimidazo[1,2-c]pyrimidine-2,5-dione
InChI:
InChI=1S/C6H5N3O2/c10-5-3-9-4(8-5)1-2-7-6(9)11/h1-2H,3H2,(H,8,10)
InChI Key:
NECHWWCOXDHSLZ-UHFFFAOYSA-N
SMILES:
O=C1Cn2c(=N1)cc[nH]c2=O
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.038g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
151.125g/mol
Monoisotopic Mass:
151.038g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3
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