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Chemical structure of Tesofensine

GC52135

Tesofensine

Also known as (1R,2R,3S,5S)-3-(3,4-dichlorophenyl)-2-(ethoxymethyl)-8-methyl-8-azabicyclo[3.2.1]octane

Tesofensine (NS-2330) is a triple monoamine reuptake inhibitor inducing a potent inhibition of the re-uptake process in the synaptic cleft of the neurotransmitters dopamine (DA; IC50=6·5 nM), norepinephrine (NE;IC50=1·7 nM), and serotonin (5-HT;IC50=11 nM), and with potentials as an anti-obesity agent

ChemicalCAS195875-84-4MW328.3FormulaC17H23Cl2NO
CAS number
195875-84-4
Molecular weight
328.3
Formula
C17H23Cl2NO
Solubility
DMF： 2 mg/mL,DMSO： 1 mg/mL,Ethanol： Slightly soluble,PBS (pH 7·2)： 0·14 mg/mL
InChIKey
VCVWXKKWDOJNIT-ZOMKSWQUSA-N
Catalogue number
GC52135
Brand
GLPBIO
Computed properties PubChem CID 11370864 · XLogP 4.5 · TPSA 12.5 Ų · H-bond donors 0
XLogP
4.5
TPSA
12.5 Ų
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
21

SMILES CCOC[C@H]1[C@H]2CC[C@H](N2C)C[C@@H]1C3=CC(=C(C=C3)Cl)Cl

Computed descriptors from PubChem (CID 11370864), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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