ABT-702 hydrochloride

CAT: 0931-T84880-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0931-T84880-01Size:10 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

2624336-92-9

Target

Others, Adenosine Receptor

Related Pathways

Others, GPCR/G Protein, Neuroscience

Bioactivity

ABT-702 hydrochloride effectively inhibits adenosine kinase, exhibiting an IC50 value of 1.7 nM [1] [2].

Smiles

NC=1C=2C(=CC(=NC2N=CN1)C=3C=CC(=NC3)N4CCOCC4)C5=CC(Br)=CC=C5.Cl

Molecular Formula

C22H20BrClN6O

Molecular Weight

499.79

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Abt-702 hydrochloride

CAS Number	2624336-92-9
PubChem CID	154578228
IUPAC Name	5-(3-bromophenyl)-7-(6-morpholin-4-yl-3-pyridinyl)pyrido[2,3-d]pyrimidin-4-amine;hydrochloride
Molecular Formula	C22H20BrClN6O
Molecular Weight	499.8
Topological Polar Surface Area	90.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	3
Heavy Atom Count	31
Formal Charge	0
Complexity	564

SMILES

C1COCCN1C2=NC=C(C=C2)C3=NC4=NC=NC(=C4C(=C3)C5=CC(=CC=C5)Br)N.Cl

InChI

InChI=1S/C22H19BrN6O.ClH/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);1H

InChIKey

KXHYOZCVILMBFV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2624336-92-9

CID: 154578228

Formula: C22H20BrClN6O

MW: 499.8

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	499.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	3
Exact Mass	498.05705
Monoisotopic Mass	498.05705
Topological Polar Surface Area	90.1 Å²
Heavy Atom Count	31
Formal Charge	0
Complexity	564
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

Related Products

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T4668L-01	ABT-702
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T63312-01	ABT-639 hydrochloride
T88896-01	ABT-751 hydrochloride
T29524-01	ABT 491 Hydrochloride
T2513-01	VX-702
T23613-01	ACH-702
TPL0202-01	Compound 702-79-4
T40951-01	ABT-107

Alternative Products

Catalog	Name
HY-112482A-01	ABT-702 (hydrochloride)
2372/10	ABT 702 hydrochloride
GTR19232613	ABT-702 hydrochloride
HY-105170B-01	ABT-418 (hydrochloride)
HY-13270A	ABT-751 (hydrochloride)
MBS387305-01	ABT-639 hydrochloride
MBS5779158	ABT 491 Hydrochloride
RFA45048-01	Abt-751 hydrochloride
XFA38883-01	ABT-418 Hydrochloride
471047	ABT-724 (hydrochloride)

ABT-702 hydrochloride

Chemical Information

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