EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:228283 - 7-ethoxy-N3-(2-furanylmethyl)-3,9-acridinediamine

ChEBI IDCHEBI:228283
ChEBI Name7-ethoxy-N3-(2-furanylmethyl)-3,9-acridinediamine
Stars
ASCII Name7-ethoxy-N(3)-(2-furanylmethyl)-3,9-acridinediamine
DefinitionA member of the class of aminoacridines that is acridin-9-amine substituted by [(furan-2-yl)methyl]amino and ethoxy groups at positions 3 and 7, respectively. It is a lysine deficient protein kinase (WNK) signaling inhibitor (IC50 = 16 μM).
Last Modified14 December 2023
Submitterdoughowe
DownloadsMolfile
FormulaC20H19N3O2
Net Charge0
Average Mass333.391
Monoisotopic Mass333.14773
SMILESCCOc1ccc2nc3cc(NCc4ccco4)ccc3c(N)c2c1
InChIInChI=1S/C20H19N3O2/c1-2-24-14-6-8-18-17(11-14)20(21)16-7-5-13(10-19(16)23-18)22-12-15-4-3-9-25-15/h3-11,22H,2,12H2,1H3,(H2,21,23)
InChIKeyPGNWQNJXXLPZEL-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
WNK signaling inhibitor  A substance that inhibits any of the WNK signalling pathway.
ChEBI Ontology
Outgoing Relation(s)
7-ethoxy-N3-(2-furanylmethyl)-3,9-acridinediamine (CHEBI:228283) has role WNK signaling inhibitor (CHEBI:228284)
7-ethoxy-N3-(2-furanylmethyl)-3,9-acridinediamine (CHEBI:228283) is a aminoacridines (CHEBI:51803)
7-ethoxy-N3-(2-furanylmethyl)-3,9-acridinediamine (CHEBI:228283) is a aromatic amine (CHEBI:33860)
7-ethoxy-N3-(2-furanylmethyl)-3,9-acridinediamine (CHEBI:228283) is a aromatic ether (CHEBI:35618)
7-ethoxy-N3-(2-furanylmethyl)-3,9-acridinediamine (CHEBI:228283) is a furans (CHEBI:24129)
IUPAC Name 
7-ethoxy-N3-(furan-2-ylmethyl)acridine-3,9-diamine
Synonyms  Source
7-ethoxy-N3-[(furan-2-yl)methyl]acridine-3,9-diamineIUPAC
STOCK2S 26016ChEBI
STOCK2S-26016ChEBI
compound BChEBI
WNK-IN-BChEBI
WNK IN BChEBI
Registry NumbersSources
CAS:332922-63-1ChEBI
Citations