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CHEBI:141969 - tipifarnib

Default Structure
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:
apoptosis inducer  Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms.
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.
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
tipifarnibWHO MedNet
tipifarnibWHO MedNet
tipifarnibWHO MedNet
tipifarnibumWHO MedNet
Synonyms  Source
(+)-(R)-6-[amino(4-chlorophenyl)(1-methyl-1H-imidazol-5-yl)methyl]-4-(3-chlorophenyl)-1-methyl-2(1H)-quinolinoneChEBI
(R)-6-(amino(4-chlorophenyl)(1-methyl-1H-imidazol-5-yl)methyl)-4-(3-chlorophenyl)-1-methyl-2(1H)-quinolinoneChemIDplus
R-115777DrugBank
R115777DrugBank
Brand Name  Source
ZarnestraDrugBank
Manual XrefsDatabases
D03720KEGG DRUG
DB04960DrugBank
TipifarnibWikipedia
Registry NumbersSources
Reaxys:9734901Reaxys
CAS:192185-72-1ChemIDplus
Citations