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CHEBI:234358 - AZD8186

ChEBI IDCHEBI:234358
ChEBI NameAZD8186
Stars
DefinitionA member of the class of chromones that is chromone substituted by morpholin-4-yl, dimethylaminoacyl, and (1R)-1-(3,5-difluoroanilino)ethyl groups at positions 2, 6, and 8, respectively. It is a potent inhibitor of PI3K-β (IC50 = 4nM) and PI3K-δ (IC50 = 12nM) with selectivity over PI3K-α (IC50 = 35 nM) and PI3K-γ (IC50 = 675 nM).
Last Modified13 June 2025
Submitteraxiao
DownloadsMolfile
FormulaC24H25F2N3O4
Net Charge0
Average Mass457.477
Monoisotopic Mass457.18131
SMILESC[C@@H](Nc1cc(F)cc(F)c1)c1cc(C(=O)N(C)C)cc2c(=O)cc(N3CCOCC3)oc12
InChIInChI=1S/C24H25F2N3O4/c1-14(27-18-11-16(25)10-17(26)12-18)19-8-15(24(31)28(2)3)9-20-21(30)13-22(33-23(19)20)29-4-6-32-7-5-29/h8-14,27H,4-7H2,1-3H3/t14-/m1/s1
InChIKeyLMJFJIDLEAWOQJ-CQSZACIVSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
EC 2.7.1.137 (phosphatidylinositol 3-kinase) inhibitor  An inhibitor of phosphatidylinositol 3-kinase, EC 2.7.1.137, a family of related enzymes capable of phosphorylating the 3 position hydroxy group of the inositol ring of a phosphatidylinositol.
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
AZD8186 (CHEBI:234358) has role antineoplastic agent (CHEBI:35610)
AZD8186 (CHEBI:234358) has role EC 2.7.1.137 (phosphatidylinositol 3-kinase) inhibitor (CHEBI:50914)
AZD8186 (CHEBI:234358) is a chromones (CHEBI:23238)
AZD8186 (CHEBI:234358) is a difluorobenzene (CHEBI:38582)
AZD8186 (CHEBI:234358) is a morpholines (CHEBI:38785)
AZD8186 (CHEBI:234358) is a secondary amino compound (CHEBI:50995)
AZD8186 (CHEBI:234358) is a substituted aniline (CHEBI:48975)
AZD8186 (CHEBI:234358) is a tertiary carboxamide (CHEBI:140326)
IUPAC Name 
8-[(1R)-1-(3,5-difluoroanilino)ethyl]-N,N-dimethyl-2-(morpholin-4-yl)-4-oxo-4H-chromene-6-carboxamide
Synonyms  Source
AZD 8186SUBMITTER
AZD-8186SUBMITTER
Manual XrefsDatabases
DB15029DrugBank
Registry NumbersSources
CAS:1627494-13-6SUBMITTER
Citations