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827575-78-0 | Benzenesulfonamide, N-(2-benzoylphenyl)-4-(2-oxo-1-pyrrolidinyl)-
CAS No: 827575-78-0 Catalog No: AG00582C MDL No:
Product Description
Catalog Number:
AG00582C
Chemical Name:
Benzenesulfonamide, N-(2-benzoylphenyl)-4-(2-oxo-1-pyrrolidinyl)-
CAS Number:
827575-78-0
Molecular Formula:
C23H20N2O4S
Molecular Weight:
420.4809
IUPAC Name:
N-(2-benzoylphenyl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
InChI:
InChI=1S/C23H20N2O4S/c26-22-11-6-16-25(22)18-12-14-19(15-13-18)30(28,29)24-21-10-5-4-9-20(21)23(27)17-7-2-1-3-8-17/h1-5,7-10,12-15,24H,6,11,16H2
InChI Key:
GVKSHCBASMBUPR-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1NS(=O)(=O)c1ccc(cc1)N1CCCC1=O)c1ccccc1
Properties
Complexity:
718
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
420.114g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
420.483g/mol
Monoisotopic Mass:
420.114g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
91.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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