CHEBI:48520 - xaliproden

ChEBI IDCHEBI:48520
ChEBI Namexaliproden
Stars
DefinitionA tetrahydropyridine that is 1,2,3,6-tetrahydropyridine which is substituted on the nitrogen by a 2-(2-naphthyl)ethyl group and at position 4 by a m-trifluoromethylphenyl group.
Last Modified22 February 2017
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC24H22F3N
Net Charge0
Average Mass381.441
Monoisotopic Mass381.17043
SMILESFC(F)(F)c1cccc(C2=CCN(CCc3ccc4ccccc4c3)CC2)c1
InChIInChI=1S/C24H22F3N/c25-24(26,27)23-7-3-6-22(17-23)20-11-14-28(15-12-20)13-10-18-8-9-19-4-1-2-5-21(19)16-18/h1-9,11,16-17H,10,12-15H2
InChIKeyWJJYZXPHLSLMGE-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
serotonergic agonist  An agent that has an affinity for serotonin receptors and is able to mimic the effects of serotonin by stimulating the physiologic activity at the cell receptors. Serotonin agonists are used as antidepressants, anxiolytics, and in the treatment of migraine disorders.
Applications:
serotonergic agonist  An agent that has an affinity for serotonin receptors and is able to mimic the effects of serotonin by stimulating the physiologic activity at the cell receptors. Serotonin agonists are used as antidepressants, anxiolytics, and in the treatment of migraine disorders.
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
xaliproden (CHEBI:48520) has role antineoplastic agent (CHEBI:35610)
xaliproden (CHEBI:48520) has role serotonergic agonist (CHEBI:35941)
xaliproden (CHEBI:48520) is a (trifluoromethyl)benzenes (CHEBI:83565)
xaliproden (CHEBI:48520) is a naphthalenes (CHEBI:25477)
xaliproden (CHEBI:48520) is a tertiary amino compound (CHEBI:50996)
xaliproden (CHEBI:48520) is a tetrahydropyridine (CHEBI:26921)
IUPAC Name 
1-[2-(2-naphthyl)ethyl]-4-[3-(trifluoromethyl)phenyl]-1,2,3,6-tetrahydropyridine
INNs  Source
xaliprodenChemIDplus
xaliprodeneWHO MedNet
xaliprodenoWHO MedNet
Synonyms  Source
1,2,3,6-tetrahydro-1-(2-(2-naphthalenyl)ethyl)-4-(3-(trifluoromethyl)phenyl)-pyridineChemIDplus
1,2,3,6-tetrahydro-1-(2-(2-naphthyl)ethyl)-4-(α,α,α-trifluoro-m-tolyl)pyridineChemIDplus
SR 57746ChEMBL
SR-57746ChEMBL
SR57746ChEMBL
Manual XrefsDatabases
4367DrugCentral
D06327KEGG DRUG
EP101381Patent
LSM-3966LINCS
US4521428Patent
Registry NumbersSources
Beilstein:8164054Beilstein
CAS:135354-02-8ChemIDplus
Citations