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67508-30-9 | Benzenesulfonamide, N,N'-1,5-pentanediylbis[4-methyl-
CAS No: 67508-30-9 Catalog No: AG0060FO MDL No:
Product Description
Catalog Number:
AG0060FO
Chemical Name:
Benzenesulfonamide, N,N'-1,5-pentanediylbis[4-methyl-
CAS Number:
67508-30-9
Molecular Formula:
C19H26N2O4S2
Molecular Weight:
410.5507
IUPAC Name:
4-methyl-N-[5-[(4-methylphenyl)sulfonylamino]pentyl]benzenesulfonamide
InChI:
InChI=1S/C19H26N2O4S2/c1-16-6-10-18(11-7-16)26(22,23)20-14-4-3-5-15-21-27(24,25)19-12-8-17(2)9-13-19/h6-13,20-21H,3-5,14-15H2,1-2H3
InChI Key:
BDBVTUYVWGRBDQ-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)NCCCCCNS(=O)(=O)c1ccc(cc1)C
Properties
Complexity:
566
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
410.133g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
410.547g/mol
Monoisotopic Mass:
410.133g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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