fisogatinib   Click here for help

GtoPdb Ligand ID: 10220

Synonyms: BLU-554 | BLU554 | CS-3008 | CS3008
Compound class: Synthetic organic
Comment: Fisogatinib (BLU-554) is an orally bioavailable, potent and highly selective fibroblast growth factor receptor 4 (FGFR4) inhibitor. It was discovered by Blueprint Medicines [1] (probably compound number 40 therein), and is being investigated for clinical anti-tumour efficacy in cancers that are driven by FGFR4 activation (for example, in liver cancers where the FGF19/FGFR4 signalling pathway is activated by genetic alteration). Structurally, fisogatinib is a derivative of BLU-9931 and is similarly an irreversible type tryosine kinase inhibitor.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 8
Topological polar surface area 94.6
Molecular weight 502.12
XLogP 4.3
No. Lipinski's rules broken 0
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Canonical SMILES C=CC(=O)NC1CCOCC1Nc1ncc2c(n1)ccc(c2)c1c(Cl)c(OC)cc(c1Cl)OC
Isomeric SMILES C=CC(=O)N[C@H]1CCOC[C@H]1Nc1ncc2c(n1)ccc(c2)c1c(Cl)c(OC)cc(c1Cl)OC
InChI InChI=1S/C24H24Cl2N4O4/c1-4-20(31)28-16-7-8-34-12-17(16)30-24-27-11-14-9-13(5-6-15(14)29-24)21-22(25)18(32-2)10-19(33-3)23(21)26/h4-6,9-11,16-17H,1,7-8,12H2,2-3H3,(H,28,31)(H,27,29,30)/t16-,17+/m0/s1
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
10947 fisogatinib
Synonyms Click here for help
BLU-554 | BLU554 | CS-3008 | CS3008
Database Links Click here for help
CAS Registry No. 1707289-21-1 (source: PubChem)
GtoPdb PubChem SID 381744902
PubChem CID 91885617
Search Google for chemical match using the InChIKey MGZKYOAQVGSSGC-DLBZAZTESA-N
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UniChem Compound Search for chemical match using the InChIKey MGZKYOAQVGSSGC-DLBZAZTESA-N
UniChem Connectivity Search for chemical match using the InChIKey MGZKYOAQVGSSGC-DLBZAZTESA-N