CHEBI:64091 - 1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazine dihydrochloride

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ChEBI Name 1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazine dihydrochloride
ChEBI ID CHEBI:64091
Definition A hydrochloride salt that is obtained by reaction of 1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazine with two equivalents of hydrogen chloride. Potent and selective inhibitor of dopamine uptake (KD = 5.5 nM in rat striatal membranes).
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C28H36Cl2N2O
Net Charge 0
Average Mass 487.50400
Monoisotopic Mass 486.22047
InChI InChI=1S/C28H34N2O.2ClH/c1-4-11-25(12-5-1)13-10-18-29-19-21-30(22-20-29)23-24-31-28(26-14-6-2-7-15-26)27-16-8-3-9-17-27;;/h1-9,11-12,14-17,28H,10,13,18-24H2;2*1H
InChIKey NQWRSILGEXNJIT-UHFFFAOYSA-N
SMILES Cl.Cl.C(CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1)Cc1ccccc1
Roles Classification
Biological Role(s): dopamine uptake inhibitor
A dopaminergic agent that blocks the transport of dopamine into axon terminals or into storage vesicles within terminals. Most of the adrenergic uptake inhibitors also inhibit dopamine uptake.
Application(s): dopamine uptake inhibitor
A dopaminergic agent that blocks the transport of dopamine into axon terminals or into storage vesicles within terminals. Most of the adrenergic uptake inhibitors also inhibit dopamine uptake.
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ChEBI Ontology
Outgoing 1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazine dihydrochloride (CHEBI:64091) has part 1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazinediium(2+) (CHEBI:64092)
1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazine dihydrochloride (CHEBI:64091) has role dopamine uptake inhibitor (CHEBI:51039)
1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazine dihydrochloride (CHEBI:64091) is a hydrochloride (CHEBI:36807)
IUPAC Name
1-[2-(diphenylmethoxy)ethyl]-4-(3-phenylpropyl)piperazine dihydrochloride
Synonyms Sources
1-[2-(diphenylmethoxy)ethyl]-4-(3-phenylpropyl)piperazinediium dichloride IUPAC
GBR 12935 dihydrochloride ChEBI
Manual Xref Database
US4202896 Patent
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Registry Number Type Source
5689635 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
10082215 PubMed citation Europe PMC
11230993 PubMed citation Europe PMC
17141211 PubMed citation Europe PMC
18216287 PubMed citation Europe PMC
9286626 PubMed citation Europe PMC
9874096 PubMed citation Europe PMC
Last Modified
05 March 2012