CHEBI:64123 - NAN 190 hydrobromide

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ChEBI Name NAN 190 hydrobromide
ChEBI ID CHEBI:64123
Definition A hydrobromide obtained by reaction of NAN 190 with one equivalent of hydrobromic acid.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C23H28BrN3O3
Net Charge 0
Average Mass 474.39100
Monoisotopic Mass 473.13140
InChI InChI=1S/C23H27N3O3.BrH/c1-29-21-11-5-4-10-20(21)25-16-14-24(15-17-25)12-6-7-13-26-22(27)18-8-2-3-9-19(18)23(26)28;/h2-5,8-11H,6-7,12-17H2,1H3;1H
InChIKey AXRUEPFPTQYHQD-UHFFFAOYSA-N
SMILES Br.COc1ccccc1N1CCN(CCCCN2C(=O)c3ccccc3C2=O)CC1
Roles Classification
Biological Role(s): serotonergic antagonist
Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or serotonergic agonists.
Application(s): serotonergic antagonist
Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or serotonergic agonists.
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ChEBI Ontology
Outgoing NAN 190 hydrobromide (CHEBI:64123) has part NAN 190(1+) (CHEBI:64132)
NAN 190 hydrobromide (CHEBI:64123) has role serotonergic antagonist (CHEBI:48279)
NAN 190 hydrobromide (CHEBI:64123) is a hydrobromide (CHEBI:48367)
IUPAC Name
2-{4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl}-1H-isoindole-1,3(2H)-dione hydrobromide
Synonyms Sources
1-(2-Methoxyphenyl)-4-(4-(2-phthalimido)butyl)piperazine hydrobromide ChemIDplus
1-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butyl]-4-(2-methoxyphenyl)piperazin-1-ium bromide IUPAC
Nan 190 ChemIDplus
NAN190 hydrobromide ChEBI
Registry Numbers Types Sources
115338-32-4 CAS Registry Number ChemIDplus
4775818 Reaxys Registry Number Reaxys
Last Modified
08 March 2012