Products for Research Use Only
RegisterLogin

ALK-IN-1

CAT: 0013-GTR19171505-02Size: 1 ml x 10 mM (in DMSO)Dry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19171505-02Size:1 ml x 10 mM (in DMSO)
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
ALK-IN-1 is a synthetic small molecule inhibitor of anaplastic lymphoma kinase (ALK), structurally related to Brigatinib. It is utilized in biochemical and cellular research to investigate ALK-driven signaling pathways and has been employed in both in vitro and in vivo studies to explore potential anti-tumor mechanisms.
CAS Number
1197958-12-5
Product Name Alternative
EGFR (C797S/del19), EGFR (del19), IGF1R, IGF-1R, AP 26113, AP26113, AP-26113, AP26113-analog, AP26113-analog, Anaplastic lymphoma kinase, Anaplastic lymphoma kinase (ALK), ALKIN1, ALK-IN-1, ALK, ALK tyrosine kinase receptor, ALK IN 1, Cluster of differentiation 246, CD246, Brigatinib, Brigatinib-analog
Field of Research
Cardiovascular Research, Signal Transduction
Purity
97.66% (May vary between batches)
Solubility
H2O:< 1 mg/mL (insoluble or slightly soluble) ; Ethanol:98 mg/mL (185.25 mM) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:2 mg/mL (3.78 mM) ; DMSO:30 mg/mL (56.71 mM)
Smiles
N (C1=C (P (C) (C) =O) C=CC=C1) C2=NC (NC3=C (OC) C=C (C=C3) N4CCC (N (C) C) CC4) =NC=C2Cl
Molecular Formula
C26H34ClN6O2P
Molecular Weight
529.01
Storage Conditions
-20°C
Notes
For research use only.

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

Related Products

CatalogName
GTR19218699-01ALK/EGFR-IN-1
GTR19207301-01ALK/ROS1-IN-1
GTR19235687-01ALK-5-IN-1
GTR19262028-01ALK/HDAC-IN-1
GTR17858373Mouse ALK Protein, clone ALK-1 Antibody
GTR17694313ALK-1/ACVRL1/ALK Rabbit Polyclonal Antibody
GTR18549658ALK-1/ACVRL1/ALK Rabbit Polyclonal Antibody (Cy3)
GTR18549613ALK-1/ACVRL1/ALK Rabbit Polyclonal Antibody (PE)
GTR18549669ALK-1/ACVRL1/ALK Rabbit Polyclonal Antibody (Biotin)
GTR18762341ALK-1/ACVRL1/ALK Rabbit Polyclonal Antibody (Fluoro488)

Alternative Products

CatalogName
A1367-10ALK-IN-1
305597-01ALK-1
HY-13464RALK-IN-1 (Standard)
T212575-01ALK ligand-1
T72931-01TRK/ALK-IN-1
341799-01ALK-1 discontinued
MBS3840749-01ALK inhibitor 1
C30105-01ALK-1 Antibody
MBS5766026ALK/ROS1-IN-1
HY-161350ALK/HDAC-IN-1

Popular Products