4-[[5-amino-1-(2,6-difluorobenzoyl)-1,2,4-triazol-3-yl]amino]benzenesulfonamide


Chemical Name: 4-[[5-amino-1-(2,6-difluorobenzoyl)-1,2,4-triazol-3-yl]amino]benzenesulfonamide
CAS Number: 443797-96-4
Product Number: AG0037G8(AGN-PC-0LQ503)
Synonyms:
MDL No:
Molecular Formula: C15H12F2N6O3S
Molecular Weight: 394.3560

Identification/Properties


Properties
MP:
149-155 °C
BP:
676.6°C at 760 mmHg
Storage:
Inert atmosphere;-10 ℃;
Form:
Solid
Computed Properties
Molecular Weight:
394.357g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
10
Rotatable Bond Count:
4
Exact Mass:
394.066g/mol
Monoisotopic Mass:
394.066g/mol
Topological Polar Surface Area:
154A^2
Heavy Atom Count:
27
Formal Charge:
0
Complexity:
630
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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