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300405-44-1 | N-phenyl-3-[3-(phenylsulfamoyl)benzenesulfonyl]benzene-1-sulfonamide
CAS No: 300405-44-1 Catalog No: AG019LEC MDL No:MFCD00622582
Product Description
Catalog Number:
AG019LEC
Chemical Name:
N-phenyl-3-[3-(phenylsulfamoyl)benzenesulfonyl]benzene-1-sulfonamide
CAS Number:
300405-44-1
Molecular Formula:
C24H20N2O6S3
Molecular Weight:
528.6204
MDL Number:
MFCD00622582
IUPAC Name:
N-phenyl-3-[3-(phenylsulfamoyl)phenyl]sulfonylbenzenesulfonamide
InChI:
InChI=1S/C24H20N2O6S3/c27-33(28,21-13-7-15-23(17-21)34(29,30)25-19-9-3-1-4-10-19)22-14-8-16-24(18-22)35(31,32)26-20-11-5-2-6-12-20/h1-18,25-26H
InChI Key:
DYFMETANWUIWPK-UHFFFAOYSA-N
SMILES:
O=S(=O)(c1cccc(c1)S(=O)(=O)Nc1ccccc1)c1cccc(c1)S(=O)(=O)Nc1ccccc1
Properties
Complexity:
923
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
528.048g/mol
Formal Charge:
0
Heavy Atom Count:
35
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
528.612g/mol
Monoisotopic Mass:
528.048g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
152A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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