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88150-08-7 | Ethanediamide, N,N-dimethyl-N'-[3-[(1-oxopropyl)amino]phenyl]-
CAS No: 88150-08-7 Catalog No: AG004D3B MDL No:
Product Description
Catalog Number:
AG004D3B
Chemical Name:
Ethanediamide, N,N-dimethyl-N'-[3-[(1-oxopropyl)amino]phenyl]-
CAS Number:
88150-08-7
Molecular Formula:
C13H17N3O3
Molecular Weight:
263.2924
IUPAC Name:
N',N'-dimethyl-N-[3-(propanoylamino)phenyl]oxamide
InChI:
InChI=1S/C13H17N3O3/c1-4-11(17)14-9-6-5-7-10(8-9)15-12(18)13(19)16(2)3/h5-8H,4H2,1-3H3,(H,14,17)(H,15,18)
InChI Key:
BOCIJTVNDHLOFN-UHFFFAOYSA-N
SMILES:
CCC(=O)Nc1cccc(c1)NC(=O)C(=O)N(C)C
Properties
Complexity:
355
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.127g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
263.297g/mol
Monoisotopic Mass:
263.127g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
78.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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