Products for Research Use Only
RegisterLogin

AP26113

CAT: 1410-M10707-02Size: 1 mL x 10 mM in DMSODry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1410-M10707-02Size:1 mL x 10 mM in DMSO
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
AP26113 is a potent ALK inhibitor with IC50 of 0.62 nM in a cell-free assay.
CAS Number
1197958-12-5
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
529.01
Molecular Formula
C26H34ClN6O2P
Notes
Research use only, not for human use.
Receptor
ALK| EGFR (C797S/del19) | EGFR (del19) | EGFR (del19) | IGF-1R

Chemical Information

5-Chloro-N2-(4-(4-(dimethylamino)-1-piperidinyl)-2-methoxyphenyl)-N4-(2-(dimethylphosphinyl)phenyl)-2,4-pyrimidinediamine
CAS Number1197958-12-5
PubChem CID57390074
IUPAC Name5-chloro-2-N-[4-[4-(dimethylamino)piperidin-1-yl]-2-methoxyphenyl]-4-N-(2-dimethylphosphorylphenyl)pyrimidine-2,4-diamine
Molecular FormulaC26H34ClN6O2P
Molecular Weight529.0
XLogP4.8
Topological Polar Surface Area82.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count8
Heavy Atom Count36
Formal Charge0
Complexity733
SMILES
CN(C)C1CCN(CC1)C2=CC(=C(C=C2)NC3=NC=C(C(=N3)NC4=CC=CC=C4P(=O)(C)C)Cl)OC
InChI
InChI=1S/C26H34ClN6O2P/c1-32(2)18-12-14-33(15-13-18)19-10-11-21(23(16-19)35-3)30-26-28-17-20(27)25(31-26)29-22-8-6-7-9-24(22)36(4,5)34/h6-11,16-18H,12-15H2,1-5H3,(H2,28,29,30,31)
InChIKey
OVDSPTSBIQCAIN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Chloro-N2-(4-(4-(dimethylamino)-1-piperidinyl)-2-methoxyphenyl)-N4-(2-(dimethylphosphinyl)phenyl)-2,4-pyrimidinediamine
CAS: 1197958-12-5
CID: 57390074
Formula: C26H34ClN6O2P
MW: 529.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight529.0
XLogP34.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count8
Exact Mass528.2169390
Monoisotopic Mass528.2169390
Topological Polar Surface Area82.6 Ų
Heavy Atom Count36
Formal Charge0
Complexity733
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
MBS3600707-01AP26113
9675-5Brigatinib (AP26113)
A11948-5AP26113 5mg
A11948-50AP26113 50mg
A11948-25AP26113 25mg
A11948-10AP26113 10mg
A13450-500Brigatinib (AP26113) 500mg
A13450-50Brigatinib (AP26113) 50mg
SF5449-5mgAP26113 (ALK inhibitor)
A13450-200Brigatinib (AP26113) 200mg

Popular Products