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ABT 702 dihydrochloride - 98%, high purity , CAS No.1188890-28-9

COA

Grade & Purity:

≥98%

Cas Number: 1188890-28-9
Molecular Weight: 536.25
PubChem CID: 16760265
PubChem SID: 504768527

In stock

Item Number

A413554

Grouped product items
SKU	Size	Availability	Price
A413554-5mg	5mg	3	$147.90
A413554-25mg	25mg	3	$666.90
A413554-50mg	50mg	2	$741.90

Adenosine Kinase Inhibitors

View related series

Adenosine Kinase (4) Amino Acid/Protein Metabolism (1836) Metabolic Enzyme/Protease (4860) Neuronal Signaling (3320)

Basic Description

Synonyms	BCP26047 \| 5-(3-Bromophenyl)-7-[6-(4-morpholinyl)-3-pyrido[2,3-d]byrimidin-4-amine dihydrochloride \| ABT702 \| 1188890-28-9 \| BCP20900 \| BS-14522 \| J-014088 \| ABT 702 Dihydrochloride; ABT 702; ABT-702; ABT702 \| ABT702 pound>>ABT 702 pound>>ABT-702 \| 4-amin
Specifications & Purity	≥98%
Biochemical and Physiological Mechanisms	ABT-702 is a novel, potent non-nucleoside Adenosine kinase inhibitor with an IC50 of 1.7 nM. It has oral activity in animal models of pain and inflammation.
Storage Temp	Store at -20°C
Shipped In	Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available.
Product Description	Information ABT 702 dihydrochloride ABT-702 is a novel, potent non-nucleoside Adenosine kinase inhibitor with an IC50 of 1.7 nM. It has oral activity in animal models of pain and inflammation. Targets adenosine kinase 1.7 nM

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Pyridines and derivatives
    - Subclass Bipyridines and oligopyridines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Pyridines and derivatives
Subclass	Bipyridines and oligopyridines
Intermediate Tree Nodes	Not available
Direct Parent	Bipyridines and oligopyridines
Alternative Parents	Pyrido[2,3-d]pyrimidines Dialkylarylamines Bromobenzenes Aminopyridines and derivatives 2-halopyridines Pyrimidines and pyrimidine derivatives Morpholines Imidolactams Heteroaromatic compounds Oxacyclic compounds Dialkyl ethers Azacyclic compounds Primary amines Organopnictogen compounds Organobromides Hydrochlorides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Bipyridine - Pyrido[2,3-d]pyrimidine - Pyridopyrimidine - Dialkylarylamine - Tertiary aliphatic/aromatic amine - 2-halopyridine - Halobenzene - Bromobenzene - Aminopyridine - Imidolactam - Benzenoid - Pyrimidine - Oxazinane - Morpholine - Monocyclic benzene moiety - Heteroaromatic compound - Tertiary amine - Oxacycle - Azacycle - Ether - Dialkyl ether - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Hydrochloride - Primary amine - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Amine - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as bipyridines and oligopyridines. These are organic compounds containing two pyridine rings linked to each other.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	504768527
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504768527
IUPAC Name	5-(3-bromophenyl)-7-(6-morpholin-4-ylpyridin-3-yl)pyrido[2,3-d]pyrimidin-4-amine;dihydrochloride
INCHI	InChI=1S/C22H19BrN6O.2ClH/c23-16-3-1-2-14(10-16)17-11-18(28-22-20(17)21(24)26-13-27-22)15-4-5-19(25-12-15)29-6-8-30-9-7-29;;/h1-5,10-13H,6-9H2,(H2,24,26,27,28);2*1H
InChIKey	OOXNYFKPOPJIOT-UHFFFAOYSA-N
Smiles	C1COCCN1C2=NC=C(C=C2)C3=NC4=NC=NC(=C4C(=C3)C5=CC(=CC=C5)Br)N.Cl.Cl
Isomeric SMILES	C1COCCN1C2=NC=C(C=C2)C3=NC4=NC=NC(=C4C(=C3)C5=CC(=CC=C5)Br)N.Cl.Cl
PubChem CID	16760265
Molecular Weight	536.25

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

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3 results found

Lot Number	Certificate Type	Date	Item
F2229230	Certificate of Analysis	Apr 03, 2025	A413554
F2229231	Certificate of Analysis	Apr 03, 2025	A413554
F2229229	Certificate of Analysis	Apr 03, 2025	A413554

Chemical and Physical Properties

Solubility	Solubility (25°C) In vitro DMSO: 100 mg/mL (186.48 mM); Ethanol: 3 mg/mL (5.59 mM); Water: Insoluble;
Molecular Weight	536.200 g/mol
XLogP3
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	3
Exact Mass	534.034 Da
Monoisotopic Mass	534.034 Da
Topological Polar Surface Area	90.100 Å²
Heavy Atom Count	32
Formal Charge	0
Complexity	564.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	3

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