Brigatinib (AP26113) is a potent and selective ALK inhibitor with IC50=0.6 nM; Also a ROS1 inhibitor, IC50=0.9 nM. It can also inhibit FLT3, FLT3(D835Y), EGFR with relatively low potency.

 

Brand: BCM

 

Melting Point: >203°C (dec.)

 

Solubility: soluble in DMSO. Insoluble in water.

 

Stability: Stable for 2 years from date of purchase as supplied. Solutions in DMSO may be stored at -20°C for up to 1 month.

 

Isomeric SMILES: CN1CCN(CC1)C2CCN(CC2)C3=CC(=C(C=C3)NC4=NC=C(C(=N4)NC5=CC=CC=C5P(=O)(C)C)Cl)OC  

 

InChIKey: AILRADAXUVEEIR-UHFFFAOYSA-N  

 

InChI: InChI=1S/C29H39ClN7O2P/c1-35-15-17-37(18-16-35)21-11-13-36(14-12-21)22-9-10-24(26(19-22)39-2)33-29-31-20-23(30)28(34-29)32-25-7-5-6-8-27(25)40(3,4)38/h5-10,19-21H,11-18H2,1-4H3,(H2,31,32,33,34)

 

Attribute
[CAS No.]	1197953-54-0
[EINECS]	1592732-453-0
[Formula]	C29H39ClN7O2P
[Molecular]	584.09200
[Storage]	-20°C
[Form]	White to off-white solid
[Chem Name]	5-chloro-4-N-(2-dimethylphosphorylphenyl)-2-N-[2-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]pyrimidine-2,4-diamine
[Synonym]	Brigatinib; AP26113

Goods Tag