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Chemical structure of Duoperone

GC31031

Duoperone

Also known as (4-fluorophenyl)-[1-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]piperidin-4-yl]methanone

Duoperone is a neuroleptic agent and also a antiemetic agent in animal models

ChemicalCAS62030-88-0MW514.58FormulaC28H26F4N2OS
CAS number
62030-88-0
Molecular weight
514.58
Formula
C28H26F4N2OS
Solubility
Soluble in DMSO
InChIKey
XMUZRUCADGTCPX-UHFFFAOYSA-N
Catalogue number
GC31031
Brand
GLPBIO
Computed properties PubChem CID 43876 · XLogP 7.2 · TPSA 48.9 Ų · H-bond donors 0
XLogP
7.2
TPSA
48.9 Ų
H-bond donors
0
H-bond acceptors
8
Rotatable bonds
6
Heavy atoms
36

SMILES C1CN(CCC1C(=O)C2=CC=C(C=C2)F)CCCN3C4=CC=CC=C4SC5=C3C=C(C=C5)C(F)(F)F

Computed descriptors from PubChem (CID 43876), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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