Paliperidone Palmitate

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 85
Total Number of Articles : 159
PubChem 9852746
Molecular Formula

C39H57FN4O4

SMILES

CCCCCCCCCCCCCCCC(=O)OC1CCCN2C1=NC(=C(C2=O)CCN3CCC(CC3)C4=NOC5=C4C=CC(=C5)F)C

InChI

InChI=1S/C39H57FN4O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-36(45)47-34-17-16-24-44-38(34)41-29(2)32(39(44)46)23-27-43-25-21-30(22-26-43)37-33-20-19-31(40)28-35(33)48-42-37/h19-20,28,30,34H,3-18,21-27H2,1-2H3

synonyms
  • Paliperidone Palmitate
  • 199739-10-1
  • Invega Sustenna
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Properties
Property Value
MW 664.9 g/mol
HBD 0
HBA 8
Rotatable Bond Count 20
Exact Mass 664.43638447 g/mol
Monoisotopic Mass 664.43638447 g/mol
Heavy Atom Count 48
Isotope Atom Count 0
Atom Stereo Count 1
Covalent Unit Count 1
Complexity 1090
xlogp 10.1
Topological Polar Surface Area 88.2