AS 602801- CAS 848344-36-5

AS 602801(Bentamapimod) is a novel, orally active inhibitor of JNK.
IC50 value:
Target: JNK
In activated PBMCs from HVs, we showed that AS602801 blocked T-lymphocyte proliferation and induced apoptosis. In RRMS CD4+ and CD8+ cells, AS602801 induced apoptosis genes and expression of surface markers, while in RRMS CD11b+ cells it induced expression of innate immunity receptors and co-stimulatory molecules. Untreated cells from RRMS active-phase patients significantly released interleukin-23 (IL-23) and interferon-gamma (IFN-γ) and expressed less apoptosis markers compared to the cells of HVs.

Catalog Number: I005085

CAS Number: 848344-36-5

PubChem Substance ID:355040360

Molecular Formula: C₂₅H₂₃N₅O₂S

Molecular Weight:457.55

Purity: ≥95%

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* For research use only. Not for human or veterinary use.

Synonym

Synonyms2-(1,3-benzothiazol-2-yl)-2-[2-[[4-(morpholin-4-ylmethyl)phenyl]methoxy]pyrimidin-4-yl]acetonitrile

Property

Molecular Formula: C₂₅H₂₃N₅O₂S
Molecular Weight457.55
Target:JNK
SolubilityDMSO:10.8 mg/mL
Purity≥95%
StorageStore at -20°C
MDLMFCD08272350

Computed Descriptor

InChIInChI=1S/C25H23N5O2S/c26-15-20(24-28-22-3-1-2-4-23(22)33-24)21-9-10-27-25(29-21)32-17-19-7-5-18(6-8-19)16-30-11-13-31-14-12-30/h1-10,20H,11-14,16-17H2
InChIKeyXCPPIJCBCWUBNT-UHFFFAOYSA-N
SMILESC1COCCN1CC2=CC=C(C=C2)COC3=NC=CC(=N3)C(C#N)C4=NC5=CC=CC=C5S4