Danazol

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 153
Total Number of Articles : 235
PubChem 28417
Molecular Formula

C22H27NO2

SMILES

C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=CC5=C(C[C@]34C)C=NO5

InChI

InChI=1S/C22H27NO2/c1-4-22(24)10-8-18-16-6-5-15-11-19-14(13-23-25-19)12-20(15,2)17(16)7-9-21(18,22)3/h1,11,13,16-18,24H,5-10,12H2,2-3H3/t16-,17+,18+,20+,21+,22+/m1/s1

synonyms
  • danazol
  • Danocrine
  • 17230-88-5
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Properties
Property Value
MW 337.5 g/mol
HBD 1
HBA 3
Rotatable Bond Count 1
Exact Mass 337.204179104 g/mol
Monoisotopic Mass 337.204179104 g/mol
Heavy Atom Count 25
Isotope Atom Count 0
Atom Stereo Count 6
Covalent Unit Count 1
Complexity 677
xlogp 3.8
Topological Polar Surface Area 46.3