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88796-87-6 | Benzenesulfonamide, N-[2-(2-methyl-4-pyridinyl)phenyl]-
CAS No: 88796-87-6 Catalog No: AG004CTG MDL No:
Product Description
Catalog Number:
AG004CTG
Chemical Name:
Benzenesulfonamide, N-[2-(2-methyl-4-pyridinyl)phenyl]-
CAS Number:
88796-87-6
Molecular Formula:
C18H16N2O2S
Molecular Weight:
324.3968
IUPAC Name:
N-[2-(2-methylpyridin-4-yl)phenyl]benzenesulfonamide
InChI:
InChI=1S/C18H16N2O2S/c1-14-13-15(11-12-19-14)17-9-5-6-10-18(17)20-23(21,22)16-7-3-2-4-8-16/h2-13,20H,1H3
InChI Key:
KNUWDLIMBVIGTL-UHFFFAOYSA-N
SMILES:
Cc1nccc(c1)c1ccccc1NS(=O)(=O)c1ccccc1
Properties
Complexity:
468
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.093g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
324.398g/mol
Monoisotopic Mass:
324.093g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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