Temozolomide

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 1349
Total Number of Articles : 2366
PubChem 5394
Molecular Formula

C6H6N6O2

SMILES

CN1C(=O)N2C=NC(=C2N=N1)C(=O)N

InChI

InChI=1S/C6H6N6O2/c1-11-6(14)12-2-8-3(4(7)13)5(12)9-10-11/h2H,1H3,(H2,7,13)

synonyms
  • temozolomide
  • 85622-93-1
  • Methazolastone
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Properties
Property Value
MW 194.15 g/mol
HBD 1
HBA 5
Rotatable Bond Count 1
Exact Mass 194.05522346 g/mol
Monoisotopic Mass 194.05522346 g/mol
Heavy Atom Count 14
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 315
xlogp -1.1
Topological Polar Surface Area 106