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188727-95-9 | Ethanediamide, N,N''-1,2-phenylenebis[N'-methyl- (9CI)
CAS No: 188727-95-9 Catalog No: AG002H7W MDL No:
Product Description
Catalog Number:
AG002H7W
Chemical Name:
Ethanediamide, N,N''-1,2-phenylenebis[N'-methyl- (9CI)
CAS Number:
188727-95-9
Molecular Formula:
C12H14N4O4
Molecular Weight:
278.2640
IUPAC Name:
N-methyl-N'-[2-[[2-(methylamino)-2-oxoacetyl]amino]phenyl]oxamide
InChI:
InChI=1S/C12H14N4O4/c1-13-9(17)11(19)15-7-5-3-4-6-8(7)16-12(20)10(18)14-2/h3-6H,1-2H3,(H,13,17)(H,14,18)(H,15,19)(H,16,20)
InChI Key:
OOMPAXSLEWQXOF-UHFFFAOYSA-N
SMILES:
CNC(=O)C(=O)Nc1ccccc1NC(=O)C(=O)NC
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.102g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
278.268g/mol
Monoisotopic Mass:
278.102g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
116A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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