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870548-83-7 | Benzenesulfonamide, N-(1,4-dihydro-2-methyl-4-oxo-7-quinolinyl)-
CAS No: 870548-83-7 Catalog No: AG004GIS MDL No:
Product Description
Catalog Number:
AG004GIS
Chemical Name:
Benzenesulfonamide, N-(1,4-dihydro-2-methyl-4-oxo-7-quinolinyl)-
CAS Number:
870548-83-7
Molecular Formula:
C16H14N2O3S
Molecular Weight:
314.3590
IUPAC Name:
N-(2-methyl-4-oxo-1H-quinolin-7-yl)benzenesulfonamide
InChI:
InChI=1S/C16H14N2O3S/c1-11-9-16(19)14-8-7-12(10-15(14)17-11)18-22(20,21)13-5-3-2-4-6-13/h2-10,18H,1H3,(H,17,19)
InChI Key:
UPUNQEFRDYLVOO-UHFFFAOYSA-N
SMILES:
Cc1cc(=O)c2c([nH]1)cc(cc2)NS(=O)(=O)c1ccccc1
Properties
Complexity:
558
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.073g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
314.359g/mol
Monoisotopic Mass:
314.073g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
83.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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