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89010-61-7 | Benzenesulfonamide, 2-[(1-benzoyl-2-oxopropyl)azo]-N-2-thiazolyl-
CAS No: 89010-61-7 Catalog No: AG0044N1 MDL No:
Product Description
Catalog Number:
AG0044N1
Chemical Name:
Benzenesulfonamide, 2-[(1-benzoyl-2-oxopropyl)azo]-N-2-thiazolyl-
CAS Number:
89010-61-7
Molecular Formula:
C19H16N4O4S2
Molecular Weight:
428.4847
IUPAC Name:
2-[(1,3-dioxo-1-phenylbutan-2-yl)diazenyl]-N-(1,3-thiazol-2-yl)benzenesulfonamide
InChI:
InChI=1S/C19H16N4O4S2/c1-13(24)17(18(25)14-7-3-2-4-8-14)22-21-15-9-5-6-10-16(15)29(26,27)23-19-20-11-12-28-19/h2-12,17H,1H3,(H,20,23)
InChI Key:
BTXIYTBDTDLTOY-UHFFFAOYSA-N
SMILES:
CC(=O)C(C(=O)c1ccccc1)N=Nc1ccccc1S(=O)(=O)Nc1nccs1
Properties
Complexity:
716
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
428.061g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
428.481g/mol
Monoisotopic Mass:
428.061g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
155A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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