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M  END
> <ID>
CHEBI:92223

> <NAME>
abexinostat

> <DEFINITION>
A 1-benzofuran substituted by {2-[4-(hydroxycarbamoyl)phenoxy]ethyl}aminocarbonyl and (dimethylamino)methyl groups at positions 2 and 3, respectively. It is a potent pan-HDAC inhibitor whose major target is HDAC1 (Ki = 7 nM).

> <STAR>
3

> <SYNONYM>
S78454; S-78454; PZP115891; PZP-115891; PCI-24781; PCI 24781; CRA-024781; CRA 24781; CRA 024781; 3-[(dimethylamino)methyl]-N-[2-[4-[(hydroxyamino)carbonyl]phenoxy]ethyl]-2-benzofurancarboxamide; 3-[(dimethylamino)methyl]-N-[2-[4-[(hydroxyamino)-oxomethyl]phenoxy]ethyl]-2-benzofurancarboxamide; 3-[(dimethylamino)methyl]-N-[2-[4-(hydroxycarbamoyl)phenoxy]ethyl]-1-benzofuran-2-carboxamide

> <IUPAC_NAME>
3-[(dimethylamino)methyl]-N-{2-[4-(hydroxycarbamoyl)phenoxy]ethyl}-1-benzofuran-2-carboxamide

> <INN>
abexinostatum; abexinostat; abexinostat; abexinostat

> <FORMULA>
C21H23N3O5

> <MASS>
397.431

> <MONOISOTOPIC_MASS>
397.16377

> <CHARGE>
0

> <SMILES>
CN(C)CC1=C(OC2=CC=CC=C12)C(=O)NCCOC1=CC=C(C=C1)C(=O)NO

> <INCHI>
InChI=1S/C21H23N3O5/c1-24(2)13-17-16-5-3-4-6-18(16)29-19(17)21(26)22-11-12-28-15-9-7-14(8-10-15)20(25)23-27/h3-10,27H,11-13H2,1-2H3,(H,22,26)(H,23,25)

> <INCHIKEY>
MAUCONCHVWBMHK-UHFFFAOYSA-N

> <CAS_REGISTRY_NUMBER>
783355-60-2

> <DRUGBANK_ACCESSION>
DB12565

> <KEGG_DRUG_ACCESSION>
D10060

> <LINCS_ACCESSION>
LSM-2269

> <WIKIPEDIA_ACCESSION>
Abexinostat

> <AGRICOLA_CITATION>
IND605480874

> <PUBMED_CENTRAL_CITATION>
PMC4144576

> <PUBMED_CITATION>
16731764; 18006784; 18042714; 19417021; 19417023; 20145726; 20461381; 21508354; 22326466; 23724141; 23737346; 23790467; 23977108; 24312289; 25110436; 25505847; 25520806; 25782916; 26750740; 27095947; 27271328; 28915585; 32534122; 33500709; 34696786; 38378603

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