Sulfasalazine

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 320
Total Number of Articles : 571
PubChem 5339
Molecular Formula

C18H14N4O5S

SMILES

C1=CC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)N=NC3=CC(=C(C=C3)O)C(=O)O

InChI

InChI=1S/C18H14N4O5S/c23-16-9-6-13(11-15(16)18(24)25)21-20-12-4-7-14(8-5-12)28(26,27)22-17-3-1-2-10-19-17/h1-11,23H,(H,19,22)(H,24,25)

synonyms
  • sulfasalazine
  • 599-79-1
  • Salicylazosulfapyridine
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Properties
Property Value
MW 398.4 g/mol
HBD 3
HBA 9
Rotatable Bond Count 6
Exact Mass 398.06849073 g/mol
Monoisotopic Mass 398.06849073 g/mol
Heavy Atom Count 28
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 657
xlogp -0.7
Topological Polar Surface Area 150