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2226303-74-6

2226303-74-6 Structure

2226303-74-6 Structure
IdentificationBack Directory
[Name]

1H-Isoindole-1,3(2H)-dione, 2-(2,6-dioxo-3-piperidinyl)-5-(2-propyn-1-yloxy)-
[CAS]

2226303-74-6
[Synonyms]

Thalidomide-5-propargyl
2-(2,6-dioxopiperidin-3-yl)-5-(prop-2-yn-1-yloxy)isoindoline-1,3-dione
1H-Isoindole-1,3(2H)-dione, 2-(2,6-dioxo-3-piperidinyl)-5-(2-propyn-1-yloxy)-
[Molecular Formula]

C16H12N2O5
[MOL File]

2226303-74-6.mol
[Molecular Weight]

312.28
Chemical PropertiesBack Directory
[Boiling point ]

587.6±50.0 °C(Predicted)
[density ]

1.469±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C, stored under nitrogen
[form ]

Solid
[pka]

10.70±0.40(Predicted)
[color ]

White to off-white
Hazard InformationBack Directory
[Uses]

Thalidomide-5-propargyl is a propargyl-modified Thalidomide (HY-14658), that acts as a Cereblon ligand to recruit CRBN proteins. Thalidomide-5-propargyl use alkynyl group at the end to be directly used in the synthesis of triazoles in the synthesis of PROTAC molecules, and is a key intermediate in the synthesis of PROTAC molecules based on CRBN design[1].
[IC 50]

Cereblon
[References]

[1] Crew, et al. Preparation of tau-protein targeting bifunctional compounds (PROTACS) as E3 ubiquitin ligase binding useful in treatment and prevention of diseases. United States, US20180125821 A1. 2018-05-10.
Spectrum DetailBack Directory
[Spectrum Detail]

1H-Isoindole-1,3(2H)-dione, 2-(2,6-dioxo-3-piperidinyl)-5-(2-propyn-1-yloxy)-(2226303-74-6)1HNMR
1H-Isoindole-1,3(2H)-dione, 2-(2,6-dioxo-3-piperidinyl)-5-(2-propyn-1-yloxy)-(2226303-74-6)13CNMR
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