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AZD-3463

CAT: 0607-A8620-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0607-A8620-10Size:10 mg
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Description
ALK/IGF1R inhibitor
CAS Number
1356962-20-3
Product Name Alternative
N-[4-(4-aminopiperidin-1-yl)-2-methoxyphenyl]-5-chloro-4-(1H-indol-3-yl)pyrimidin-2-amine
Field of Research
Tyrosine Kinase ALK
Purity
0.981
Form
A solid
Solubility
insoluble in H2O; insoluble in EtOH; ≥11.22 mg/mL in DMSO
Smiles
COC1=C(C=CC(=C1)N2CCC(CC2)N)NC3=NC=C(C(=N3)C4=CNC5=CC=CC=C54)Cl
Molecular Formula
C24H25ClN6O
Molecular Weight
448.95
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

Azd3463

AZD3463 is a member of the class of indoles that is 1H-indole substituted by a 2-[4-(4-aminopiperidin-1-yl)-2-methoxyanilino]-5-chloropyrimidin-4-yl group at position 3. It is an orally bioavailable dual inhibitor of ALK and IGF1R with Ki value of 0.75 nM for ALK. It has a role as an autophagy inducer, an antineoplastic agent, an EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor and an apoptosis inducer. It is a member of indoles, a monomethoxybenzene, an organochlorine compound, an aminopyrimidine, an aminopiperidine, a secondary amino compound and a tertiary amino compound.

CAS Number1356962-20-3
PubChem CID56599293
IUPAC NameN-[4-(4-aminopiperidin-1-yl)-2-methoxyphenyl]-5-chloro-4-(1H-indol-3-yl)pyrimidin-2-amine
Molecular FormulaC24H25ClN6O
Molecular Weight448.9
XLogP4.2
Topological Polar Surface Area92.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count32
Formal Charge0
Complexity605
SMILES
COC1=C(C=CC(=C1)N2CCC(CC2)N)NC3=NC=C(C(=N3)C4=CNC5=CC=CC=C54)Cl
InChI
InChI=1S/C24H25ClN6O/c1-32-22-12-16(31-10-8-15(26)9-11-31)6-7-21(22)29-24-28-14-19(25)23(30-24)18-13-27-20-5-3-2-4-17(18)20/h2-7,12-15,27H,8-11,26H2,1H3,(H,28,29,30)
InChIKey
GCYIGMXOIWJGBU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Azd3463
CAS: 1356962-20-3
CID: 56599293
Formula: C24H25ClN6O
MW: 448.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight448.9
XLogP34.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass448.1778371
Monoisotopic Mass448.1778371
Topological Polar Surface Area92.1 Ų
Heavy Atom Count32
Formal Charge0
Complexity605
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

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