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136668-01-4 | Propanamide, N,N'-1,2-phenylenebis[2-amino-2-methyl-
CAS No: 136668-01-4 Catalog No: AG001279 MDL No:
Product Description
Catalog Number:
AG001279
Chemical Name:
Propanamide, N,N'-1,2-phenylenebis[2-amino-2-methyl-
CAS Number:
136668-01-4
Molecular Formula:
C14H22N4O2
Molecular Weight:
278.3501
IUPAC Name:
2-amino-N-[2-[(2-amino-2-methylpropanoyl)amino]phenyl]-2-methylpropanamide
InChI:
InChI=1S/C14H22N4O2/c1-13(2,15)11(19)17-9-7-5-6-8-10(9)18-12(20)14(3,4)16/h5-8H,15-16H2,1-4H3,(H,17,19)(H,18,20)
InChI Key:
DOIZZPIVJOAGOX-UHFFFAOYSA-N
SMILES:
O=C(C(N)(C)C)Nc1ccccc1NC(=O)C(N)(C)C
Properties
Complexity:
343
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.174g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
278.356g/mol
Monoisotopic Mass:
278.174g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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