CAS 100957-85-5|SORT-PGRN interaction inhibitor 1

Introduction：Basic information about CAS 100957-85-5|SORT-PGRN interaction inhibitor 1, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameSORT-PGRN interaction inhibitor 1
CAS Number100957-85-5Molecular Weight258.31600
Density1.12g/cm3Boiling Point438.4ºC at 760 mmHg
Molecular FormulaC15H18N2O2Melting Point126ºC
MSDS/Flash Point218.9ºC

Names

Name2-benzyl-5-tert-butylpyrazole-3-carboxylic acid
SynonymMore Synonyms

SORT-PGRN interaction inhibitor 1 BiologicalActivity

DescriptionSORT-PGRN interaction inhibitor 1 is a potent inhibitor of the sortilin-progranulin interaction with an IC50 of 2 μM[1].
Related CatalogSignaling Pathways >>GPCR/G Protein >>Neurotensin ReceptorResearch Areas >>Neurological Disease
Target

IC50: 2 μM (Sortilin-progranulin interaction)[1]

In VitroSORT-PGRN interaction inhibitor 1 (Compound 2) with sufficient potency and physicochemical properties to enable co-crystallization with sortilin[1].
References

[1]. Shawn J Stachel, et al. Identification of potent inhibitors of the sortilin-progranulin interaction. Bioorg Med Chem Lett. 2020 Sep 1;30(17):127403.

Chemical & Physical Properties

Density1.12g/cm3
Boiling Point438.4ºC at 760 mmHg
Melting Point126ºC
Molecular FormulaC15H18N2O2
Molecular Weight258.31600
Flash Point218.9ºC
Exact Mass258.13700
PSA55.12000
LogP2.92710
Vapour Pressure1.85E-08mmHg at 25°C
Index of Refraction1.568

Safety Information

Hazard CodesXi
Risk PhrasesR36/37/38
Safety PhrasesS26
HS Code2933199090

Customs

HS Code2933199090
Summary2933199090. other compounds containing an unfused pyrazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Synonyms

2-benzyl-5-tert-butyl-2H-pyrazole-3-carboxylic acid
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