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Home > Pyridines > 929975-35-9
929975-35-9 | 1-(5-cyano-6-oxo-1,6-dihydropyridine-3-carbonyl)-1,3-dimethylurea
CAS No: 929975-35-9 Catalog No: AG019KGB MDL No:MFCD09040423
Product Description
Catalog Number:
AG019KGB
Chemical Name:
1-(5-cyano-6-oxo-1,6-dihydropyridine-3-carbonyl)-1,3-dimethylurea
CAS Number:
929975-35-9
Molecular Formula:
C10H10N4O3
Molecular Weight:
234.2114
MDL Number:
MFCD09040423
IUPAC Name:
5-cyano-N-methyl-N-(methylcarbamoyl)-6-oxo-1H-pyridine-3-carboxamide
InChI:
InChI=1S/C10H10N4O3/c1-12-10(17)14(2)9(16)7-3-6(4-11)8(15)13-5-7/h3,5H,1-2H3,(H,12,17)(H,13,15)
InChI Key:
GNUJIEXOIXYPOV-UHFFFAOYSA-N
SMILES:
CNC(=O)N(C(=O)c1c[nH]c(=O)c(c1)C#N)C
Properties
Complexity:
495
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.075g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
234.215g/mol
Monoisotopic Mass:
234.075g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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