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65116-57-6 | Benzenesulfonamide,4-(2,5-dioxo-3-phenyl-1-pyrrolidinyl)-3-methoxy-
CAS No: 65116-57-6 Catalog No: AG006S2P MDL No:
Product Description
Catalog Number:
AG006S2P
Chemical Name:
Benzenesulfonamide,4-(2,5-dioxo-3-phenyl-1-pyrrolidinyl)-3-methoxy-
CAS Number:
65116-57-6
Molecular Formula:
C17H16N2O5S
Molecular Weight:
360.3843
IUPAC Name:
4-(2,5-dioxo-3-phenylpyrrolidin-1-yl)-3-methoxybenzenesulfonamide
InChI:
InChI=1S/C17H16N2O5S/c1-24-15-9-12(25(18,22)23)7-8-14(15)19-16(20)10-13(17(19)21)11-5-3-2-4-6-11/h2-9,13H,10H2,1H3,(H2,18,22,23)
InChI Key:
VFWNZERMYDGNKC-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1N1C(=O)CC(C1=O)c1ccccc1)S(=O)(=O)N
Properties
Complexity:
623
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
360.078g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
360.384g/mol
Monoisotopic Mass:
360.078g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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