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2707510-30-1

2707510-30-1 Structure

2707510-30-1 Structure
IdentificationBack Directory
[Name]

INDEX NAME NOT YET ASSIGNED
[CAS]

2707510-30-1
[Synonyms]

GRP78-IN-3
(S)-N-(3-Methyl-1-oxo-1-(thiazol-2-ylamino)butan-2-yl)-1H-indole-2-carboxamide
[Molecular Formula]

C17H18N4O2S
[MOL File]

2707510-30-1.mol
[Molecular Weight]

342.42
Chemical PropertiesBack Directory
[density ]

1.355±0.06 g/cm3(Predicted)
[form ]

Solid
[pka]

8.34±0.50(Predicted)
[color ]

White to off-white
Hazard InformationBack Directory
[Uses]

GRP78-IN-3 (Compound 8) is a selective Grp78 (HSPA5) inhibitor with an IC50 of 0.59 μM. GRP78-IN-3 is 7-fold selective for HspA5 compared to HspA9 (IC50 of 4.3 μM) and >20-fold selective for HspA5 compared to HspA2 (IC50 of 13.9 μM)[1].
[IC 50]

HSPA5: 0.59 μM (IC50)
[References]

[1] Andrew J Ambrose, et al. Discovery and Development of a Selective Inhibitor of the ER Resident Chaperone Grp78. J Med Chem. 2022 Dec 14. DOI:10.1021/acs.jmedchem.2c01631
Spectrum DetailBack Directory
[Spectrum Detail]

(S)-N-(3-Methyl-1-oxo-1-(thiazol-2-ylamino)butan-2-yl)-1H-indole-2-carboxamide(2707510-30-1)1HNMR
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