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Home > Bromides > 1823958-95-7
1823958-95-7 | Imidazo[1,2-a]pyrimidine-2-carboxamide, 3-bromo-
CAS No: 1823958-95-7 Catalog No: AG0023TE MDL No:
Product Description
Catalog Number:
AG0023TE
Chemical Name:
Imidazo[1,2-a]pyrimidine-2-carboxamide, 3-bromo-
CAS Number:
1823958-95-7
Molecular Formula:
C7H5BrN4O
Molecular Weight:
241.0448
IUPAC Name:
3-bromoimidazo[1,2-a]pyrimidine-2-carboxamide
InChI:
InChI=1S/C7H5BrN4O/c8-5-4(6(9)13)11-7-10-2-1-3-12(5)7/h1-3H,(H2,9,13)
InChI Key:
QCKHMVFXUFKLNL-UHFFFAOYSA-N
SMILES:
NC(=O)c1nc2n(c1Br)cccn2
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.965g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
241.048g/mol
Monoisotopic Mass:
239.965g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
73.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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