Pantoprazole

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 138
Total Number of Articles : 167
PubChem 4679
Molecular Formula

C16H15F2N3O4S

SMILES

COC1=C(C(=NC=C1)CS(=O)C2=NC3=C(N2)C=C(C=C3)OC(F)F)OC

InChI

InChI=1S/C16H15F2N3O4S/c1-23-13-5-6-19-12(14(13)24-2)8-26(22)16-20-10-4-3-9(25-15(17)18)7-11(10)21-16/h3-7,15H,8H2,1-2H3,(H,20,21)

synonyms
  • pantoprazole
  • 102625-70-7
  • Pantozol
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Properties
Property Value
MW 383.4 g/mol
HBD 1
HBA 9
Rotatable Bond Count 7
Exact Mass 383.07513347 g/mol
Monoisotopic Mass 383.07513347 g/mol
Heavy Atom Count 26
Isotope Atom Count 0
Atom Stereo Count 1
Covalent Unit Count 1
Complexity 490
xlogp 2.4
Topological Polar Surface Area 106