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72802-68-7 | Benzenesulfonamide, N-[(2,5-dioxo-1-pyrrolidinyl)methyl]-N-methyl-
CAS No: 72802-68-7 Catalog No: AG005EM9 MDL No:
Product Description
Catalog Number:
AG005EM9
Chemical Name:
Benzenesulfonamide, N-[(2,5-dioxo-1-pyrrolidinyl)methyl]-N-methyl-
CAS Number:
72802-68-7
Molecular Formula:
C12H14N2O4S
Molecular Weight:
282.3156
IUPAC Name:
N-[(2,5-dioxopyrrolidin-1-yl)methyl]-N-methylbenzenesulfonamide
InChI:
InChI=1S/C12H14N2O4S/c1-13(9-14-11(15)7-8-12(14)16)19(17,18)10-5-3-2-4-6-10/h2-6H,7-9H2,1H3
InChI Key:
PTFBUJMBFITWRB-UHFFFAOYSA-N
SMILES:
CN(S(=O)(=O)c1ccccc1)CN1C(=O)CCC1=O
Properties
Complexity:
447
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.067g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.314g/mol
Monoisotopic Mass:
282.067g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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