Pimozide

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 206
Total Number of Articles : 241
PubChem 16362
Molecular Formula

C28H29F2N3O

SMILES

C1CN(CCC1N2C3=CC=CC=C3NC2=O)CCCC(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F

InChI

InChI=1S/C28H29F2N3O/c29-22-11-7-20(8-12-22)25(21-9-13-23(30)14-10-21)4-3-17-32-18-15-24(16-19-32)33-27-6-2-1-5-26(27)31-28(33)34/h1-2,5-14,24-25H,3-4,15-19H2,(H,31,34)

synonyms
  • pimozide
  • 2062-78-4
  • Orap
Click to show/hide the synonyms
Properties
Property Value
MW 461.5 g/mol
HBD 1
HBA 4
Rotatable Bond Count 7
Exact Mass 461.22786888 g/mol
Monoisotopic Mass 461.22786888 g/mol
Heavy Atom Count 34
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 632
xlogp 6.3
Topological Polar Surface Area 35.6