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88148-67-8 | 3-Pyridinecarboxamide, 4-(2-bromophenyl)-1,2-dihydro-2-oxo-
CAS No: 88148-67-8 Catalog No: AG004D3L MDL No:
Product Description
Catalog Number:
AG004D3L
Chemical Name:
3-Pyridinecarboxamide, 4-(2-bromophenyl)-1,2-dihydro-2-oxo-
CAS Number:
88148-67-8
Molecular Formula:
C12H9BrN2O2
Molecular Weight:
293.1161
IUPAC Name:
4-(2-bromophenyl)-2-oxo-1H-pyridine-3-carboxamide
InChI:
InChI=1S/C12H9BrN2O2/c13-9-4-2-1-3-7(9)8-5-6-15-12(17)10(8)11(14)16/h1-6H,(H2,14,16)(H,15,17)
InChI Key:
STWGGLPBGZJEEP-UHFFFAOYSA-N
SMILES:
Brc1ccccc1c1cc[nH]c(=O)c1C(=O)N
Properties
Complexity:
415
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.985g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
293.12g/mol
Monoisotopic Mass:
291.985g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
72.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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