Vortioxetine

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 85
Total Number of Articles : 97
PubChem 9966051
Molecular Formula

C18H22N2S

SMILES

CC1=CC(=C(C=C1)SC2=CC=CC=C2N3CCNCC3)C

InChI

InChI=1S/C18H22N2S/c1-14-7-8-17(15(2)13-14)21-18-6-4-3-5-16(18)20-11-9-19-10-12-20/h3-8,13,19H,9-12H2,1-2H3

synonyms
  • VORTIOXETINE
  • 508233-74-7
  • 1-(2-((2,4-Dimethylphenyl)thio)phenyl)piperazine
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Properties
Property Value
MW 298.4 g/mol
HBD 1
HBA 3
Rotatable Bond Count 3
Exact Mass 298.15036988 g/mol
Monoisotopic Mass 298.15036988 g/mol
Heavy Atom Count 21
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 316
xlogp 4.2
Topological Polar Surface Area 40.6