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BAY 8002 - ≥98%(HPLC), high purity , CAS No.724440-27-1, Inhibitor of Monocarboxylate transporter 1;Inhibitor of Monocarboxylate transporter 2

COA

Grade & Purity:

Moligand™

≥98%(HPLC)

Cas Number: 724440-27-1
Molecular Weight: 415.85
PubChem CID: 992293
PubChem SID: 504760358

In stock

Item Number

B288827

Grouped product items
SKU	Size	Availability	Price
B288827-5mg	5mg	2	$93.90
B288827-10mg	10mg	2	$137.90
B288827-50mg	50mg	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$424.90
B288827-100mg	100mg	2	$692.90

Potent dual MCT1/2 inhibitor

View related series

Membrane Transporter (607) Membrane Transporter/Ion Channel (1822) Monocarboxylate Transporter (13) Monocarboxylate transporter 1 Inhibitor (3) Monocarboxylate transporter 2 Inhibitor (3)

Basic Description

Synonyms	BAY-8002
Specifications & Purity	Moligand™, ≥98%(HPLC)
Biochemical and Physiological Mechanisms	Potent dual MCT1/2 inhibitor (IC50values are 3, 8, and 12 nM at rat (C6), human (DLD-1) and mouse (4T1) MCT1 respectively; IC50values of human MCT1, MCT2, and MCT4 isoforms recombinantly expressed inX. laevisoocytes are 1, 5 and >500 nM, respectively); su
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.
Grade	Moligand™
Action Type	INHIBITOR
Mechanism of action	Inhibitor of Monocarboxylate transporter 1;Inhibitor of Monocarboxylate transporter 2

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Anilides
      - Level5 Aromatic anilides
        Level6 Benzanilides

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Anilides
Intermediate Tree Nodes	Aromatic anilides
Direct Parent	Benzanilides
Alternative Parents	2-halobenzoic acids and derivatives Benzamides Benzenesulfonyl compounds Benzoic acids Benzoyl derivatives Chlorobenzenes Aryl chlorides Vinylogous halides Vinylogous amides Sulfones Secondary carboxylic acid amides Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organic oxides Organochlorides Organonitrogen compounds Organooxygen compounds Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Benzanilide - Halobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Benzenesulfonyl group - Benzoic acid - Benzoyl - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Vinylogous amide - Vinylogous halide - Sulfone - Sulfonyl - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organochloride - Organic oxygen compound - Organohalogen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as benzanilides. These are aromatic compounds containing an anilide group in which the carboxamide group is substituted with a benzene ring. They have the general structure RNC(=O)R', where R,R'= benzene.
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)

SLC16A7 Tchem Monocarboxylate transporter 2 (0 Activities)

Discover Target: SLC16A7

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

SLC16A1 Tchem Monocarboxylate transporter 1 (0 Activities)

Discover Target: SLC16A1

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

Names and Identifiers

Pubchem Sid	504760358
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504760358
IUPAC Name	2-[[5-(benzenesulfonyl)-2-chlorobenzoyl]amino]benzoic acid
INCHI	InChI=1S/C20H14ClNO5S/c21-17-11-10-14(28(26,27)13-6-2-1-3-7-13)12-16(17)19(23)22-18-9-5-4-8-15(18)20(24)25/h1-12H,(H,22,23)(H,24,25)
InChIKey	CLAUJSRBKSRTGQ-UHFFFAOYSA-N
Smiles	C1=CC=C(C=C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=CC=C3C(=O)O
Isomeric SMILES	C1=CC=C(C=C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=CC=C3C(=O)O
MeSH Entry Terms	2-(((2-chloro-5-(phenylsulfonyl)phenyl)-carbonyl)amino)benzoic acid;BAY-8002
Molecular Weight	415.85
Reaxy-Rn	34791084
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=34791084&ln=

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.

5 results found

Lot Number	Certificate Type	Date	Item
L2404259	Certificate of Analysis	Dec 07, 2024	B288827
J2113379	Certificate of Analysis	Jul 18, 2024	B288827
J2113380	Certificate of Analysis	Jul 18, 2024	B288827
J2113381	Certificate of Analysis	Jul 18, 2024	B288827
J2113382	Certificate of Analysis	Jul 18, 2024	B288827

Chemical and Physical Properties

Solubility	Solvent:DMSO, Max Conc. mg/mL: 41.58, Max Conc. mM: 100
Molecular Weight	415.800 g/mol
XLogP3	4.300
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	5
Exact Mass	415.028 Da
Monoisotopic Mass	415.028 Da
Topological Polar Surface Area	109.000 Å²
Heavy Atom Count	28
Formal Charge	0
Complexity	671.000
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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