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13952-56-2 | Benzenesulfonamide, 4,4'-(1,2-ethanediyl)bis[N,N-dimethyl-
CAS No: 13952-56-2 Catalog No: AG001B71 MDL No:
Product Description
Catalog Number:
AG001B71
Chemical Name:
Benzenesulfonamide, 4,4'-(1,2-ethanediyl)bis[N,N-dimethyl-
CAS Number:
13952-56-2
Molecular Formula:
C18H24N2O4S2
Molecular Weight:
396.5242
IUPAC Name:
4-[2-[4-(dimethylsulfamoyl)phenyl]ethyl]-N,N-dimethylbenzenesulfonamide
InChI:
InChI=1S/C18H24N2O4S2/c1-19(2)25(21,22)17-11-7-15(8-12-17)5-6-16-9-13-18(14-10-16)26(23,24)20(3)4/h7-14H,5-6H2,1-4H3
InChI Key:
PWYAKAUWOKAXFG-UHFFFAOYSA-N
SMILES:
CN(S(=O)(=O)c1ccc(cc1)CCc1ccc(cc1)S(=O)(=O)N(C)C)C
Properties
Complexity:
574
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
396.118g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
396.52g/mol
Monoisotopic Mass:
396.118g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
91.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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