Computed Properties
Complexity:
1520
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
678.174412g/mol
Formal Charge:
0
Heavy Atom Count:
48
Hydrogen Bond Acceptor Count:
14
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
678.7g/mol
Monoisotopic Mass:
678.174412g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
246Ų
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Synonyms
ThioFluor 623
1004324-99-5
SCHEMBL10304712
C31H30N6O10S
2072AH
ZINC97972495
J-000131
Benzenesulfonamide, N-[4-[(1E)-2-[4-cyano-5-(dicyanomethylene)-2,5-dihydro-2,2-dimethyl-3-furanyl]ethenyl]phenyl]-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2,4-dinitro-
N-[4-[2-[2,2-Dimethyl-4-cyano-5-(dicyanomethylene)-2,5-dihydrofuran-3-yl]ethenyl]phenyl]-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2,4-dinitrobenzenesulfonamide