5-Nitro-6,7-dichloro-1,4-dihydro-2,3-quinoxalinedione , CAS No.153504-81-5

CAS: 153504-81-5 Cat. No.: N335499 Molecular Weight: 276.03
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Synonyms
J-009022 | 6,7-Dichloro-5-nitro-1,4-dihydro-quinoxaline-2,3-dione | 6,7-dichloro-5-nitro-1,4-dihydroquinoxaline-2,3-dione | ACEA 1021 | D04728 | 5-Nitro-6,7-dichloro-2,3-quinoxalinedione | MLS006010858 | CHFSOFHQIZKQCR-UHFFFAOYSA-N | UNII-3Z3037LJTC | 3-m
Storage
Store at 2-8°C
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
5mg
N335499-5mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$136.90
25mg
N335499-25mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$619.90
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Why this grade

for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Store at 2-8°C Ships Wet ice Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Overview

5-Nitro-6,7-dichloro-1,4-dihydro-2,3-quinoxalinedione is a strong and selective NMDA receptor glycine site antagonist.

Specifications

Synonyms
J-009022 | 6, 7-Dichloro-5-nitro-1, 4-dihydro-quinoxaline-2, 3-dione | 6, 7-dichloro-5-nitro-1, 4-dihydroquinoxaline-2, 3-dione | ACEA 1021 | D04728 | 5-Nitro-6, 7-dichloro-2, 3-quinoxalinedione | MLS006010858 | CHFSOFHQIZKQCR-UHFFFAOYSA-N | UNII-3Z3037LJTC | 3-m
Storage
Store at 2-8°C
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Action Type
ANTAGONIST
Names and Identifiers
Canonical SmilesC1=C2C(=C(C(=C1Cl)Cl)[N+](=O)[O-])NC(=O)C(=O)N2
IUPAC Name6,7-dichloro-5-nitro-1,4-dihydroquinoxaline-2,3-dione
InChIKeyCHFSOFHQIZKQCR-UHFFFAOYSA-N
INCHI1S/C8H3Cl2N3O4/c9-2-1-3-5(6(4(2)10)13(16)17)12-8(15)7(14)11-3/h1H,(H,11,14)(H,12,15)
Isomeric SMILES C1=C2C(=C(C(=C1Cl)Cl)[N+](=O)[O-])NC(=O)C(=O)N2
Molecular Weight 276.03
Reaxy-Rn 7415459
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=7415459&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassDiazanaphthalenes
SubclassBenzodiazines
Intermediate Tree Nodes Not available
Direct ParentQuinoxalines
Alternative Parents Nitroaromatic compounds  Pyrazines  Aryl chlorides  Benzenoids  Heteroaromatic compounds  Lactams  Propargyl-type 1,3-dipolar organic compounds  Azacyclic compounds  Organic oxoazanium compounds  Organooxygen compounds  Organic oxides  Hydrocarbon derivatives  Organic salts  Organochlorides  Organonitrogen compounds  Organic cations  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Quinoxaline - Nitroaromatic compound - Aryl chloride - Aryl halide - Pyrazine - Benzenoid - Heteroaromatic compound - Lactam - C-nitro compound - Organic nitro compound - Organic oxoazanium - Azacycle - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic salt - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic cation - Aromatic heteropolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as quinoxalines. These are compounds containing a quinoxaline moiety, a bicyclic heterocycle made up of a benzene ring fused to a pyrazine ring.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
GRIN1 Tclin Glutamate (NMDA) receptor subunit zeta 1 (122 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ALB Tchem Serum albumin (2651 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
Mus musculus (284745 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Rattus norvegicus (775804 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Grin1 Glutamate NMDA receptor (6467 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Gria2 Glutamate receptor ionotropic, AMPA (2103 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
SolubilitySoluble in DMSO or dilute aqueous base
Molecular Weight276.030 g/mol
XLogP31.500
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass274.95 Da
Monoisotopic Mass274.95 Da
Topological Polar Surface Area104.000 Ų
Heavy Atom Count17
Formal Charge0
Complexity385.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
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