EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:141969 - tipifarnib

ChEBI IDCHEBI:141969
ChEBI Nametipifarnib
Stars
DefinitionA quinolone that is 1-methylquinolin-2-one which carries a 3-chlorophenyl and an amino(4-chlorophenyl)(1-methyl-imidazol-5-yl)methyl groups at the 4 and 6 positions, respectively (the R-isomer).
Last Modified29 August 2018
SubmitterAdnan
DownloadsMolfile
FormulaC27H22Cl2N4O
Net Charge0
Average Mass489.406
Monoisotopic Mass488.11707
SMILESCn1cncc1[C@@](N)(c1ccc(Cl)cc1)c1ccc2c(c1)c(-c1cccc(Cl)c1)cc(=O)n2C
InChIInChI=1S/C27H22Cl2N4O/c1-32-16-31-15-25(32)27(30,18-6-9-20(28)10-7-18)19-8-11-24-23(13-19)22(14-26(34)33(24)2)17-4-3-5-21(29)12-17/h3-16H,30H2,1-2H3/t27-/m1/s1
InChIKeyPLHJCIYEEKOWNM-HHHXNRCGSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
EC 2.5.1.58 (protein farnesyltransferase) inhibitor  An EC 2.5.1.* (non-methyl-alkyl or aryl transferase) inhibitor that interferes with the action of protein farnesyltransferase (EC 2.5.1.58), one of the three enzymes in the prenyltransferase group.
apoptosis inducer  Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms.
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
tipifarnib (CHEBI:141969) has role antineoplastic agent (CHEBI:35610)
tipifarnib (CHEBI:141969) has role apoptosis inducer (CHEBI:68495)
tipifarnib (CHEBI:141969) has role EC 2.5.1.58 (protein farnesyltransferase) inhibitor (CHEBI:64133)
tipifarnib (CHEBI:141969) is a imidazoles (CHEBI:24780)
tipifarnib (CHEBI:141969) is a monochlorobenzenes (CHEBI:83403)
tipifarnib (CHEBI:141969) is a primary amino compound (CHEBI:50994)
tipifarnib (CHEBI:141969) is a quinolone (CHEBI:23765)
IUPAC Name 
6-[(R)-amino(4-chlorophenyl)(1-methyl-1H-imidazol-5-yl)methyl]-4-(3-chlorophenyl)-1-methylquinolin-2(1H)-one
INNs  Source
tipifarnibumWHO MedNet
tipifarnibWHO MedNet
tipifarnibWHO MedNet
tipifarnibWHO MedNet
Synonyms  Source
(R)-6-(amino(4-chlorophenyl)(1-methyl-1H-imidazol-5-yl)methyl)-4-(3-chlorophenyl)-1-methyl-2(1H)-quinolinoneChemIDplus
R115777DrugBank
R-115777DrugBank
(+)-(R)-6-[amino(4-chlorophenyl)(1-methyl-1H-imidazol-5-yl)methyl]-4-(3-chlorophenyl)-1-methyl-2(1H)-quinolinoneChEBI
Brand Name  Source
ZarnestraDrugBank
Manual XrefsDatabases
DB04960DrugBank
D03720KEGG DRUG
TipifarnibWikipedia
Registry NumbersSources
Reaxys:9734901Reaxys
CAS:192185-72-1ChemIDplus
Citations