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191215-75-5 | Benzamide, 4,4'-sulfonylbis[N-phenyl-
CAS No: 191215-75-5 Catalog No: AG002F52 MDL No:
Product Description
Catalog Number:
AG002F52
Chemical Name:
Benzamide, 4,4'-sulfonylbis[N-phenyl-
CAS Number:
191215-75-5
Molecular Formula:
C26H20N2O4S
Molecular Weight:
456.5130
IUPAC Name:
N-phenyl-4-[4-(phenylcarbamoyl)phenyl]sulfonylbenzamide
InChI:
InChI=1S/C26H20N2O4S/c29-25(27-21-7-3-1-4-8-21)19-11-15-23(16-12-19)33(31,32)24-17-13-20(14-18-24)26(30)28-22-9-5-2-6-10-22/h1-18H,(H,27,29)(H,28,30)
InChI Key:
ACCOHPBXPBLICS-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)S(=O)(=O)c1ccc(cc1)C(=O)Nc1ccccc1)Nc1ccccc1
Properties
Complexity:
692
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
456.114g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
456.516g/mol
Monoisotopic Mass:
456.114g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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