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CM 4620 - 99%, high purity , CAS No.1713240-67-5, Channel blocker of Orai1;Channel blocker of Orai2

COA

Grade & Purity:

Moligand™

≥99%

Cas Number: 1713240-67-5
Molecular Weight: 421.76
PubChem CID: 122507647

In stock

Item Number

C413652

Grouped product items
SKU	Size	Availability	Price
C413652-5mg	5mg	1	$69.90
C413652-10mg	10mg	1	$109.90
C413652-25mg	25mg	1	$209.90
C413652-50mg	50mg	1	$329.90
C413652-100mg	100mg	1	$529.90

Calcium Channel Inhibitors

View related series

CRAC Channel (18) Ion channel (2197) Membrane Transporter/Ion Channel (1822) Orai1 Channel blocker (5) Orai2 Channel blocker (3)

Basic Description

Synonyms	BS-15636 \| CM 4620 \| C73294 \| BDBM50575336 \| SCHEMBL18038390 \| 564AW1RR37 \| SB18686 \| AC-35758 \| CM4620 \| CM-4620 \| N-[5-(6-Chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyrazinyl]-2-fluoro-6-methylbenzamide \| HY-101942 \| N-[5-(6-chloro-2,2-difluoro-1,3-ben
Specifications & Purity	Moligand™, ≥99%
Biochemical and Physiological Mechanisms	CM 4620 is an inhibitor of calcium-release activated calcium-channel (CRAC channel). CM4620 inhibits Orai1/STIM1-mediated Ca2+ currents and Orai2/STIM1-mediated currents with IC50 of near 120 nM and 900 nM, respectively.
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	CHANNEL BLOCKER
Mechanism of action	Channel blocker of Orai1;Channel blocker of Orai2
Product Description	Information CM 4620 CM 4620 is an inhibitor of calcium-release activated calcium-channel (CRAC channel) . CM4620 inhibits Orai1/STIM1-mediated Ca2+ currents and Orai2/STIM1-mediated currents with IC50 of near 120 nM and 900 nM, respectively. Targets Orai1/STIM1-mediated Ca2+ currents (Cell-free assay); Orai2/STIM1-mediated currents (Cell-free assay) 120 nM; 900 nM

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Benzoic acids and derivatives
      - Level5 Halobenzoic acids and derivatives
        Level6 2-halobenzoic acids and derivatives

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzoic acids and derivatives
Intermediate Tree Nodes	Halobenzoic acids and derivatives
Direct Parent	2-halobenzoic acids and derivatives
Alternative Parents	o-Toluamides Benzodioxoles Benzamides Benzoyl derivatives Fluorobenzenes Pyrazines Imidolactams Aryl fluorides Aryl chlorides Vinylogous halides Heteroaromatic compounds Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organofluorides Organochlorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	2-halobenzoic acid or derivatives - O-toluamide - Toluamide - Benzodioxole - Benzamide - Benzoyl - Toluene - Halobenzene - Fluorobenzene - Imidolactam - Pyrazine - Aryl halide - Aryl fluoride - Aryl chloride - Heteroaromatic compound - Vinylogous halide - Secondary carboxylic acid amide - Carboxamide group - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organochloride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as 2-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 2-position of the benzene ring.
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)

ORAI1 Tchem Calcium release-activated calcium channel protein 1 (1 Activities)

Discover Target: ORAI1

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

ORAI2 Tchem Protein orai-2 (1 Activities)

Discover Target: ORAI2

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

U2OS (164939 Activities)

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

HEK293 (82097 Activities)

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

HEK-293T (167025 Activities)

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

ORAI1 Tchem ORAI1/STIM1 (242 Activities)

Discover Target: ORAI1

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

IUPAC Name	N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-fluoro-6-methylbenzamide
INCHI	InChI=1S/C19H11ClF3N3O3/c1-9-3-2-4-12(21)17(9)18(27)26-16-8-24-13(7-25-16)10-5-14-15(6-11(10)20)29-19(22,23)28-14/h2-8H,1H3,(H,25,26,27)
InChIKey	QQMKTHUGOQDEIL-UHFFFAOYSA-N
Smiles	CC1=C(C(=CC=C1)F)C(=O)NC2=NC=C(N=C2)C3=CC4=C(C=C3Cl)OC(O4)(F)F
Isomeric SMILES	CC1=C(C(=CC=C1)F)C(=O)NC2=NC=C(N=C2)C3=CC4=C(C=C3Cl)OC(O4)(F)F
Alternate CAS	1713240-67-5
MeSH Entry Terms	Auxora;CM 4620;CM-128;CM-4620;CM128;CM4620;N-(5-(6-chloro-2,2-difluorobenzo(d)(1,3)dioxol-5-yl)pyrazin-2-yl)-2-fluoro-6-methylbenzamide;zegocractin
Molecular Weight	421.76
Reaxy-Rn	30170730
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=30170730&ln=

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

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Analytical Chart:

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10 results found

Lot Number	Certificate Type	Date	Item
C2425193	Certificate of Analysis	Feb 19, 2024	C413652
C2425194	Certificate of Analysis	Feb 19, 2024	C413652
C2425195	Certificate of Analysis	Feb 19, 2024	C413652
C2425196	Certificate of Analysis	Feb 19, 2024	C413652
C2425197	Certificate of Analysis	Feb 19, 2024	C413652
C2425198	Certificate of Analysis	Feb 19, 2024	C413652
C2425199	Certificate of Analysis	Feb 19, 2024	C413652
C2425200	Certificate of Analysis	Feb 19, 2024	C413652
C2425204	Certificate of Analysis	Feb 19, 2024	C413652
C2425205	Certificate of Analysis	Feb 19, 2024	C413652

Chemical and Physical Properties

Solubility	Solubility (25°C) In vitro DMSO: 100 mg/mL (237.1 mM);
Molecular Weight	421.800 g/mol
XLogP3	4.300
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	3
Exact Mass	421.044 Da
Monoisotopic Mass	421.044 Da
Topological Polar Surface Area	73.300 Å²
Heavy Atom Count	29
Formal Charge	0
Complexity	616.000
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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CM 4620 - 99%, high purity , CAS No.1713240-67-5, Channel blocker of Orai1;Channel blocker of Orai2

Basic Description

Taxonomic Classification

Associated Targets(Human)

Mechanisms of Action

Names and Identifiers

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

Chemical and Physical Properties

Alternative Products

Solution Calculators

Molarity Calculator

Dilution Calculator

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