ChemicalBook--->CAS DataBase List--->130089-98-4

130089-98-4

130089-98-4 Structure

130089-98-4 Structure
IdentificationBack Directory
[Name]

NQ301
[CAS]

130089-98-4
[Synonyms]

NQ301
NQ 301; NQ-301
NQ301 >=98% (HPLC)
NQ301 - Compound 211
2-(4-Acetylanilino)-3-chloronaphthalene-1,4-dione
2-[(4-Acetylphenyl)amino]-3-chloro-1,4-naphthalenedione
2-((4-acetylphenyl)amino)-3-chloronaphthalene-1,4-dione
1,4-Naphthalenedione, 2-[(4-acetylphenyl)amino]-3-chloro-
[Molecular Formula]

C18H12ClNO3
[MDL Number]

MFCD00559986
[MOL File]

130089-98-4.mol
[Molecular Weight]

325.75
Chemical PropertiesBack Directory
[Melting point ]

241-243 °C(Solv: ethanol (64-17-5))
[Boiling point ]

476.8±45.0 °C(Predicted)
[density ]

1.40±0.1 g/cm3(Predicted)
[storage temp. ]

2-8°C
[solubility ]

DMSO:10.0(Max Conc. mg/mL);30.7(Max Conc. mM)
[form ]

powder
[pka]

-5.25±0.20(Predicted)
[color ]

faint red to dark red
[InChI]

1S/C18H12ClNO3/c1-10(21)11-6-8-12(9-7-11)20-16-15(19)17(22)13-4-2-3-5-14(13)18(16)23/h2-9,20H,1H3
[InChIKey]

LSQZKIQSQHZVQS-UHFFFAOYSA-N
[SMILES]

O=C1C(Cl)=C(NC2=CC=C(C(C)=O)C=C2)C(C3=CC=CC=C31)=O
Safety DataBack Directory
[Symbol(GHS) ]


GHS07,GHS09
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335-H400
[Precautionary statements ]

P273-P280-P304+P340+P312-P305+P351+P338-P337+P313-P391
[RIDADR ]

UN 3077 9 / PGIII
[WGK Germany ]

WGK 3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Aquatic Acute 1
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Uses]

NQ 301 possess antiplatelet effect, making it an antithrombotic agent. It significantly inhibited the collagen-?, thrombin-?, arachidonic acid-?, thapsigargin- and calcium ionophore A23187-?induced aggregation of washed human platelets.
[Biochem/physiol Actions]

NQ301 is an antithrombotic agent. Recent study shows that NQ301 (Compound 211) is a highly potent, selective, non-competitive allosteric inhibitor of CD45 that selectively inhibits dephosphorylation of substrate Lck pY-505 versus Lck pY-393. NQ301 prevents T cell receptor-mediated activation of Lck, Zap-70 and MAPK, and IL-2 production in primary T-cells. NQ301 exhibits immunosuppressive activity in mice.
Spectrum DetailBack Directory
[Spectrum Detail]

NQ301(130089-98-4)1HNMR
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