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2875046-31-2

2875046-31-2 Structure

2875046-31-2 Structure
IdentificationBack Directory
[Name]

1-[(3R)-3-(3,4-Dichlorophenyl)-1-piperidinyl]-3-[(3R)-1-(methylsulfonyl)-3-pyrrolidinyl]-2-propyn-1-one
[CAS]

2875046-31-2
[Synonyms]

1-[(3R)-3-(3,4-Dichlorophenyl)-1-piperidinyl]-3-[(3R)-1-(methylsulfonyl)-3-pyrrolidinyl]-2-propyn-1-one
[Molecular Formula]

C19H22Cl2N2O3S
[MOL File]

2875046-31-2.mol
[Molecular Weight]

429.36
Chemical PropertiesBack Directory
[Boiling point ]

570.2±60.0 °C(Predicted)
[density ]

1.42±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)
[form ]

Solid
[pka]

-2.23±0.40(Predicted)
[color ]

White to off-white
Hazard InformationBack Directory
[Uses]

(R,R)-VVD-118313 is the isomer of VVD-118313 (HY-151385). VVD-118313 is a selective JAK1 inhibitor and blocks JAK1-dependent trans-phosphorylation and cytokine signaling. VVD-118313 can be used for research of cancer[1]. (R,R)-VVD-118313 is a click chemistry reagent, it contains an Alkyne group and can undergo copper-catalyzed azide-alkyne cycloaddition (CuAAc) with molecules containing Azide groups.
[in vivo]

VVD-118313 (compound 5a; 25-50 mg/kg; i.h.; once) inhibits JAK1 signaling in TYK2 knockout mice[1].

[IC 50]

JAK1
[References]

[1] Kavanagh ME, et, al. Selective inhibitors of JAK1 targeting an isoform-restricted allosteric cysteine. Nat Chem Biol. 2022 Sep 12. DOI:10.1038/s41589-022-01098-0
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