EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:90933 - cariprazine

ChEBI IDCHEBI:90933
ChEBI Namecariprazine
Stars
DefinitionAn N-alkylpiperazine that is N,N-dimethyl-N'-{trans-4-[2-(piperazin-1-yl)ethyl]cyclohexyl}urea substituted at position 4 on the piperazine ring by a 2,3-dichlorophenyl group. Used (as the hydrochloride salt) for treatment of schizophrenia and bipolar disorder.
Last Modified22 February 2017
SubmitterSteve
DownloadsMolfile
FormulaC21H32Cl2N4O
Net Charge0
Average Mass427.420
Monoisotopic Mass426.19532
SMILESCN(C)C(=O)N[C@H]1CC[C@H](CCN2CCN(c3cccc(Cl)c3Cl)CC2)CC1
InChIInChI=1S/C21H32Cl2N4O/c1-25(2)21(28)24-17-8-6-16(7-9-17)10-11-26-12-14-27(15-13-26)19-5-3-4-18(22)20(19)23/h3-5,16-17H,6-15H2,1-2H3,(H,24,28)/t16-,17-
InChIKeyKPWSJANDNDDRMB-QAQDUYKDSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
dopamine agonist  A drug that binds to and activates dopamine receptors.
serotonergic antagonist  Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or serotonergic agonists.
Applications:
dopamine agonist  A drug that binds to and activates dopamine receptors.
second generation antipsychotic  Antipsychotic drugs which can have different modes of action but which tend to be less likely than first generation antipsychotics to cause extrapyramidal motor control disabilities such as body rigidity or Parkinson's disease-type movements.
serotonergic antagonist  Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or serotonergic agonists.
ChEBI Ontology
Outgoing Relation(s)
cariprazine (CHEBI:90933) has role dopamine agonist (CHEBI:51065)
cariprazine (CHEBI:90933) has role second generation antipsychotic (CHEBI:65191)
cariprazine (CHEBI:90933) has role serotonergic antagonist (CHEBI:48279)
cariprazine (CHEBI:90933) is a N-alkylpiperazine (CHEBI:46845)
cariprazine (CHEBI:90933) is a N-arylpiperazine (CHEBI:46848)
cariprazine (CHEBI:90933) is a dichlorobenzene (CHEBI:23697)
cariprazine (CHEBI:90933) is a ureas (CHEBI:47857)
cariprazine (CHEBI:90933) is conjugate base of cariprazine(1+) (CHEBI:90934)
Incoming Relation(s)
cariprazine(1+) (CHEBI:90934) is conjugate acid of cariprazine (CHEBI:90933)
IUPAC Name 
N'-(trans-4-{2-[4-(2,3-dichlorophenyl)piperazin-1-yl]ethyl}cyclohexyl)-N,N-dimethylurea
INN  Source
cariprazineKEGG DRUG
Synonyms  Source
RGH-188ChemIDplus
RGH 188ChemIDplus
Manual XrefsDatabases
D09997KEGG DRUG
DB06016DrugBank
CariprazineWikipedia
5037DrugCentral
Registry NumbersSources
Reaxys:18784658Reaxys
CAS:839712-12-8KEGG DRUG
CAS:839712-12-8ChemIDplus
Citations