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Home > Imidazoles > 7253-79-4
7253-79-4 | N-(3,4-DIMETHYLPHENYL)-2-(2,5-DIOXOIMIDAZOLIDIN-4-YL)ETHANESULFONAMIDE
CAS No: 7253-79-4 Catalog No: AG005GF1 MDL No:
Product Description
Catalog Number:
AG005GF1
Chemical Name:
N-(3,4-DIMETHYLPHENYL)-2-(2,5-DIOXOIMIDAZOLIDIN-4-YL)ETHANESULFONAMIDE
CAS Number:
7253-79-4
Molecular Formula:
C13H17N3O4S
Molecular Weight:
311.3568
IUPAC Name:
N-(3,4-dimethylphenyl)-2-(2,5-dioxoimidazolidin-4-yl)ethanesulfonamide
InChI:
InChI=1S/C13H17N3O4S/c1-8-3-4-10(7-9(8)2)16-21(19,20)6-5-11-12(17)15-13(18)14-11/h3-4,7,11,16H,5-6H2,1-2H3,(H2,14,15,17,18)
InChI Key:
CHZAVUSDNOXCAS-UHFFFAOYSA-N
SMILES:
O=C1NC(=O)C(N1)CCS(=O)(=O)Nc1ccc(c(c1)C)C
NSC Number:
21281
Properties
Complexity:
514
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.094g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
311.356g/mol
Monoisotopic Mass:
311.094g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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