CHEBI:3205 - buclizine

ChEBI IDCHEBI:3205
ChEBI Namebuclizine
Stars
DefinitionAn N-alkylpiperazine carrying (4-chlorophenyl)(phenyl)methyl and 4-tert-butylbenzyl groups.
Last Modified22 February 2017
DownloadsMolfile
FormulaC28H33ClN2
Net Charge0
Average Mass433.039
Monoisotopic Mass432.23323
SMILESCC(C)(C)c1ccc(CN2CCN(C(c3ccccc3)c3ccc(Cl)cc3)CC2)cc1
InChIInChI=1S/C28H33ClN2/c1-28(2,3)25-13-9-22(10-14-25)21-30-17-19-31(20-18-30)27(23-7-5-4-6-8-23)24-11-15-26(29)16-12-24/h4-16,27H,17-21H2,1-3H3
InChIKeyMOYGZHXDRJNJEP-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
histamine antagonist  Histamine antagonists are the drugs that bind to but do not activate histamine receptors, thereby blocking the actions of histamine or histamine agonists.
cholinergic antagonist  Any drug that binds to but does not activate cholinergic receptors, thereby blocking the actions of acetylcholine or cholinergic agonists.
Applications:
antiemetic  A drug used to prevent nausea or vomiting. An antiemetic may act by a wide range of mechanisms: it might affect the medullary control centres (the vomiting centre and the chemoreceptive trigger zone) or affect the peripheral receptors.
central nervous system depressant  A loosely defined group of drugs that tend to reduce the activity of the central nervous system.
histamine antagonist  Histamine antagonists are the drugs that bind to but do not activate histamine receptors, thereby blocking the actions of histamine or histamine agonists.
cholinergic antagonist  Any drug that binds to but does not activate cholinergic receptors, thereby blocking the actions of acetylcholine or cholinergic agonists.
local anaesthetic  Any member of a group of drugs that reversibly inhibit the propagation of signals along nerves. Wide variations in potency, stability, toxicity, water-solubility and duration of action determine the route used for administration, e.g. topical, intravenous, epidural or spinal block.
ChEBI Ontology
Outgoing Relation(s)
buclizine (CHEBI:3205) has role antiemetic (CHEBI:50919)
buclizine (CHEBI:3205) has role central nervous system depressant (CHEBI:35488)
buclizine (CHEBI:3205) has role cholinergic antagonist (CHEBI:48873)
buclizine (CHEBI:3205) has role histamine antagonist (CHEBI:37956)
buclizine (CHEBI:3205) has role local anaesthetic (CHEBI:36333)
buclizine (CHEBI:3205) is a N-alkylpiperazine (CHEBI:46845)
buclizine (CHEBI:3205) is a monochlorobenzenes (CHEBI:83403)
buclizine (CHEBI:3205) is conjugate base of buclizine(2+) (CHEBI:61192)
Incoming Relation(s)
buclizine(2+) (CHEBI:61192) is conjugate acid of buclizine (CHEBI:3205)
IUPAC Name 
1-(4-tert-butylbenzyl)-4-[(4-chlorophenyl)(phenyl)methyl]piperazine
INNs  Source
buclizineChemIDplus
buclizineWHO MedNet
buclizinumWHO MedNet
buclizinaWHO MedNet
Synonyms  Source
BuclizineKEGG COMPOUND
1-(p-tert-Butylbenzyl)-4-(4-chloro-alpha-phenylbenzyl)piperazineChemIDplus
Manual XrefsDatabases
C07777KEGG COMPOUND
D07547KEGG DRUG
DB00354DrugBank
US2709169Patent
BuclizineWikipedia
GB1311286Patent
HMDB0014498HMDB
416DrugCentral
Registry NumbersSources
Reaxys:349567Reaxys
CAS:82-95-1KEGG COMPOUND
CAS:82-95-1ChemIDplus
CAS:82-95-1NIST Chemistry WebBook
Citations