Gilteritinib fumarateProduct ingredient for Gilteritinib
- Name
- Gilteritinib fumarate
- Drug Entry
- Gilteritinib
Gilteritinib, also known as ASP2215, is a small molecule part of the FLT3 tyrosine kinase inhibitors that presented a greater selectivity and potency when compared with other agents from this group.1 It is a pyrazinecarboxamide derivative that showed high selectivity to FLT3 preventing the c-Kit -driven myelosuppression observed in other therapies.5 Gilteritinib was developed by Astellas Pharma and FDA approved on November 28, 2018. This drug was approved after being designed as an orphan drug with a fast track and priority review status.7
- Accession Number
- DBSALT002819
- Structure
Structure for Gilteritinib fumarate (DBSALT002819)
- Synonyms
- Gilteritinib hemifumarate
- UNII
- 5RZZ0Z1GJT
- CAS Number
- 1254053-84-3
- Weight
- Average: 1221.52
Monoisotopic: 1220.718233226 - Chemical Formula
- C62H92N16O10
- InChI Key
- UJOUWHLYTQFUCU-WXXKFALUSA-N
- InChI
- InChI=1S/2C29H44N8O3.C4H4O4/c2*1-4-23-28(31-20-9-17-40-18-10-20)34-29(26(33-23)27(30)38)32-21-5-6-24(25(19-21)39-3)37-11-7-22(8-12-37)36-15-13-35(2)14-16-36;5-3(6)1-2-4(7)8/h2*5-6,19-20,22H,4,7-18H2,1-3H3,(H2,30,38)(H2,31,32,34);1-2H,(H,5,6)(H,7,8)/b;;2-1+
- IUPAC Name
- (2E)-but-2-enedioic acid; bis(6-ethyl-3-({3-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl}amino)-5-[(oxan-4-yl)amino]pyrazine-2-carboxamide)
- SMILES
- OC(=O)\C=C\C(O)=O.CCC1=C(NC2CCOCC2)N=C(NC2=CC=C(N3CCC(CC3)N3CCN(C)CC3)C(OC)=C2)C(=N1)C(N)=O.CCC1=C(NC2CCOCC2)N=C(NC2=CC=C(N3CCC(CC3)N3CCN(C)CC3)C(OC)=C2)C(=N1)C(N)=O
- External Links
- ChemSpider
- 32055843
- ChEMBL
- CHEMBL3301603
- Wikipedia
- Gilteritinib
- Predicted Properties
Property Value Source Water Solubility 0.0223 mg/mL ALOGPS logP 3.51 ALOGPS logP 2.79 Chemaxon logS -4.4 ALOGPS pKa (Strongest Acidic) 14.21 Chemaxon pKa (Strongest Basic) 8.47 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 10 Chemaxon Hydrogen Donor Count 3 Chemaxon Polar Surface Area 121.11 Å2 Chemaxon Rotatable Bond Count 20 Chemaxon Refractivity 159.84 m3·mol-1 Chemaxon Polarizability 62.92 Å3 Chemaxon Number of Rings 10 Chemaxon Bioavailability 0 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule Yes Chemaxon