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CHEBI:180499 - RK-24466

ChEBI IDCHEBI:180499
ChEBI NameRK-24466
Stars
DefinitionA member of the class of pyrrolopyrimidines that is 7H-pyrrolo[2,3-d]pyrimidine substituted by amino, 4-phenoxyphenyl, and cyclopentyl groups at positions 4, 5 and 7, respectively. It is a potent inhibitor of Lck that inhibits Lck (64-509) and LckCD isoforms (IC50 of less than 1 and 2 nM, respectively).
Last Modified22 September 2021
SubmitterAdnan
DownloadsMolfile
FormulaC23H22N4O
Net Charge0
Average Mass370.456
Monoisotopic Mass370.17936
SMILESNc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2C1CCCC1
InChIInChI=1S/C23H22N4O/c24-22-21-20(14-27(17-6-4-5-7-17)23(21)26-15-25-22)16-10-12-19(13-11-16)28-18-8-2-1-3-9-18/h1-3,8-15,17H,4-7H2,(H2,24,25,26)
InChIKeyFMETVQKSDIOGPX-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
EC 2.7.10.2 (non-specific protein-tyrosine kinase) inhibitor  An EC 2.7.10.* (protein-tyrosine kinase) inhibitor that specifically blocks the action of non-specific protein-tyrosine kinase (EC 2.7.10.2).
Application:
geroprotector  Any compound that supports healthy aging, slows the biological aging process, or extends lifespan.
ChEBI Ontology
Outgoing Relation(s)
RK-24466 (CHEBI:180499) has role EC 2.7.10.2 (non-specific protein-tyrosine kinase) inhibitor (CHEBI:76617)
RK-24466 (CHEBI:180499) has role geroprotector (CHEBI:176497)
RK-24466 (CHEBI:180499) is a aromatic amine (CHEBI:33860)
RK-24466 (CHEBI:180499) is a aromatic ether (CHEBI:35618)
RK-24466 (CHEBI:180499) is a cyclopentanes (CHEBI:23493)
RK-24466 (CHEBI:180499) is a primary amino compound (CHEBI:50994)
RK-24466 (CHEBI:180499) is a pyrrolopyrimidine (CHEBI:38670)
IUPAC Name 
7-cyclopentyl-5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Synonyms  Source
4-amino-5-(4-phenoxyphenyl)-7H-pyrrolo[3,2-d]pyrimidin-7-yl-cyclopentaneChEBI
7-cyclopentyl-5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-ylamineChEBI
KIN 001-51ChEBI
KIN001-051ChEBI
RK 24466ChEBI
RK24466ChEBI
Manual XrefsDatabases
5036104ChemSpider
Registry NumbersSources
CAS:213743-31-8ChEBI
Citations