dBET21

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MedKoo CAT#: 130153

CAS#: N/A

Description: dBET21 is a BET degrader. BET proteins, specifically alteration of the regulation of the proteins, play an important role in the development of certain types of cancers and inflammatory diseases, making BET a valuable target for treatment.

Chemical Structure

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dBET21
CAS# N/A
Instruction

Theoretical Analysis

MedKoo Cat#: 130153
Name: dBET21
CAS#: N/A
Chemical Formula: 40H42ClN7O6S
Exact Mass: 783.26
Molecular Weight: 784.330
Elemental Analysis: C, 61.25; H, 5.40; Cl, 4.52; N, 12.50; O, 12.24; S, 4.09

Price and Availability

This product is not in stock, which may be available by custom synthesis. For cost-effective reason, minimum order is 1g (price is usually high, lead time is 2~3 months, depending on the technical challenge). Quote less than 1g will not be provided. To request quote, please email to sales @medkoo.com or click below button.
Note: Price will be listed if it is available in the future.

Request quote for custom synthesis

Synonym: dBET21; dBET 21; dBET-21

IUPAC/Chemical Name: 2-((S)-4-(4-chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-6-yl)-N-(8-((2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindolin-4-yl)oxy)octyl)acetamide

InChi Key: QYTHDSMOGXMOPE-XLTVJXRZSA-N

InChi Code: InChI=1S/C40H42ClN7O6S/c1-22-23(2)55-40-33(22)35(25-13-15-26(41)16-14-25)43-28(36-46-45-24(3)47(36)40)21-32(50)42-19-8-6-4-5-7-9-20-54-30-12-10-11-27-34(30)39(53)48(38(27)52)29-17-18-31(49)44-37(29)51/h10-16,28-29H,4-9,17-21H2,1-3H3,(H,42,50)(H,44,49,51)/t28-,29?/m0/s1

SMILES Code: O=C(NCCCCCCCCOC1=CC=CC(C(N2C(CC3)C(NC3=O)=O)=O)=C1C2=O)C[C@@H]4N=C(C5=CC=C(Cl)C=C5)C6=C(SC(C)=C6C)N7C(C)=NN=C47

Appearance: To be determined

Purity: >98% (or refer to the Certificate of Analysis)

Shipping Condition: Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.

Storage Condition: Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).

Solubility: To be determined

Shelf Life: >2 years if stored properly

Drug Formulation: To be determined

Stock Solution Storage: 0 - 4 C for short term (days to weeks), or -20 C for long term (months).

HS Tariff Code: 2934.99.9001

More Info: BET proteins play a key role in regulating cell proliferation and cell cycle progression, by recruiting transcriptional complexes through binding to acetylated lysine residues on histones.

Biological target:
In vitro activity:
In vivo activity:

Preparing Stock Solutions

The following data is based on the product molecular weight 784.33 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
Formulation protocol:
In vitro protocol:
In vivo protocol:

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1. Bhela IP, Ranza A, Balestrero FC, Serafini M, Aprile S, Di Martino RMC, Condorelli F, Pirali T. A Versatile and Sustainable Multicomponent Platform for the Synthesis of Protein Degraders: Proof-of-Concept Application to BRD4-Degrading PROTACs. J Med Chem. 2022 Nov 2;65(22):15282–99. doi: 10.1021/acs.jmedchem.2c01218. Epub ahead of print. PMID: 36323630; PMCID: PMC9706574.