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TC-S 7009 - ≥99%(HPLC), high purity , CAS No.1422955-31-4

COA

Grade & Purity:

≥99%(HPLC)

Cas Number: 1422955-31-4
Molecular Weight: 308.65
PubChem CID: 70697712
PubChem SID: 504771974

In stock

Item Number

T286573

Grouped product items
SKU	Size	Availability	Price
T286573-5mg	5mg	3	$78.90
T286573-10mg	10mg	3	$147.90
T286573-25mg	25mg	2	$296.90
T286573-50mg	50mg	2	$534.90
T286573-100mg	100mg	2	$962.90

High affinity and selective HIF-2α inhibitor

View related series

Glucose Metabolism (1943) HIF/HIF Prolyl-Hydroxylase (128) Metabolic Enzyme/Protease (4860)

Basic Description

Synonyms	MS-24479 \| AKOS040742689 \| Q27451504 \| HIF-2 inhibitor 2 \| TC-S 7009 \| 4ghi \| HIF-2 ANTAGONIST 2 \| 2,1,3-Benzoxadiazol-5-aMine,N-(3-chloro-5-fluorophenyl)-4-nitro- \| N-(3-Chloro-5-Fluorophenyl)-4-Nitro-2,1,3-Benzoxadiazol-5-Amine \| E99008 \| CDQUJZKBRAFWNG
Specifications & Purity	≥99%(HPLC)
Biochemical and Physiological Mechanisms	High affinity and selective HIF-2αinhibitor (Kd= 81 nM). Binds to the HIF-2αPAS-B domain; disrupts HIF-2α-ARNT heterodimerization. Exhibits >60-fold selectivity for HIF-2αover HIF-1α. Decreases HIF-2αDNA-binding and attenuates expression of HIF-2αtarget g
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	Product description TC-S 7009 is a potent and selective HIF-2α inhibitor with a Kd of 81 nM. TC-S 7009 is more selective for HIF-2α than HIF-1α (Kd ≫ 5 μM). TC-S 7009 disrupts HIF-2α heterodimerization, decreases DNA-binding activity, and reduces HIF-2α target gene expression.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Benzoxadiazoles

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Benzoxadiazoles
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Benzoxadiazoles
Alternative Parents	Aniline and substituted anilines Nitroaromatic compounds Chlorobenzenes Fluorobenzenes Primary aromatic amines Aryl chlorides Aryl fluorides Heteroaromatic compounds Furazans Secondary amines Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organochlorides Organofluorides
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Benzoxadiazole - Nitroaromatic compound - Aniline or substituted anilines - Chlorobenzene - Fluorobenzene - Halobenzene - Aryl chloride - Monocyclic benzene moiety - Primary aromatic amine - Aryl halide - Benzenoid - Aryl fluoride - Furazan - Oxadiazole - Azole - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Secondary amine - Organic oxoazanium - Organic 1,3-dipolar compound - Azacycle - Oxacycle - Organic oxide - Organohalogen compound - Organochloride - Amine - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Organic zwitterion - Organic salt - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as benzoxadiazoles. These are organic compounds containing a benzene fused to an oxadiazole ring (a five-membered ring with two carbon atoms, one nitrogen atom, and one oxygen atom).
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

Associated Targets(Human)

EPAS1 Tclin Endothelial PAS domain-containing protein 1 (2 Activities)

Discover Target: EPAS1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

EPAS1 Tclin Endothelial PAS domain-containing protein 1 (498 Activities)

Discover Target: EPAS1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

ARNT Tbio Aryl hydrocarbon receptor nuclear translocator/Endothelial PAS domain-containing protein 1 (77 Activities)

Discover Target: ARNT

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

Hdac6 Histone deacetylase 6 (222 Activities)

Discover Target: Hdac6

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

Pubchem Sid	504771974
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504771974
IUPAC Name	N-(3-chloro-5-fluorophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine
INCHI	InChI=1S/C12H6ClFN4O3/c13-6-3-7(14)5-8(4-6)15-10-2-1-9-11(17-21-16-9)12(10)18(19)20/h1-5,15H
InChIKey	CDQUJZKBRAFWNG-UHFFFAOYSA-N
Smiles	C1=CC2=NON=C2C(=C1NC3=CC(=CC(=C3)Cl)F)[N+](=O)[O-]
Isomeric SMILES	C1=CC2=NON=C2C(=C1NC3=CC(=CC(=C3)Cl)F)[N+](=O)[O-]
PubChem CID	70697712
Molecular Weight	308.65

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

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

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

10 results found

Lot Number	Certificate Type	Date	Item
F2317696	Certificate of Analysis	May 23, 2023	T286573
F2317693	Certificate of Analysis	May 23, 2023	T286573
F2317689	Certificate of Analysis	May 23, 2023	T286573
F2317691	Certificate of Analysis	May 23, 2023	T286573
F2317699	Certificate of Analysis	May 23, 2023	T286573
F2317840	Certificate of Analysis	May 23, 2023	T286573
F2317703	Certificate of Analysis	May 23, 2023	T286573
F2317697	Certificate of Analysis	May 23, 2023	T286573
F2317835	Certificate of Analysis	May 23, 2023	T286573
F2317834	Certificate of Analysis	May 23, 2023	T286573

Chemical and Physical Properties

Solubility	Solvent:DMSO, Max Conc. mg/mL: 30.86, Max Conc. mM: 100
Molecular Weight	308.650 g/mol
XLogP3	3.800
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	2
Exact Mass	308.011 Da
Monoisotopic Mass	308.011 Da
Topological Polar Surface Area	96.800 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	399.000
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	1

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