MedKoo Cat#: 121193 | Name: AUN87837

Description:

WARNING: This product is for research use only, not for human or veterinary use.

AUN87837, also known as (S,R,S)-AHPC-PEG2-butyl azide, is a ProTAC building block. This conjugate contains a von Hippel-Lindau (VHL)-recruiting ligand, a linker with both hydrophobic and hydrophilic moieties, and a pendant azide for click chemistry with a target ligand. When used with other protein degrader building blocks with a pendant azide group, parallel synthesis can be used to more quickly generate ProTAC libraries that feature variation in crosslinker length, composition, and E3 ligase ligand. This product has no formal name at the moment. For the convenience of communication, a temporal code name was therefore proposed according to MedKoo Chemical Nomenclature (see web page: https://www.medkoo.com/page/naming).

Chemical Structure

AUN87837
AUN87837
CAS#2421187-83-7

Theoretical Analysis

MedKoo Cat#: 121193

Name: AUN87837

CAS#: 2421187-83-7

Chemical Formula: C32H47N7O6S

Exact Mass: 657.3309

Molecular Weight: 657.83

Elemental Analysis: C, 58.43; H, 7.20; N, 14.90; O, 14.59; S, 4.87

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.
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Related CAS #
No Data
Synonym
(S,R,S)-AHPC-PEG2-butyl azide; AUN87837; AUN 87837; AUN-87837
IUPAC/Chemical Name
(2S,4R)-1-((S)-2-(2-(2-((6-Azidohexyl)oxy)ethoxy)acetamido)-3,3-dimethylbutanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide, (S,R,S)-AHPC-2-2-6-N3
InChi Key
AQQCBOMPDQRUHN-UWPQIUOOSA-N
InChi Code
InChI=1S/C32H47N7O6S/c1-22-28(46-21-35-22)24-11-9-23(10-12-24)18-34-30(42)26-17-25(40)19-39(26)31(43)29(32(2,3)4)37-27(41)20-45-16-15-44-14-8-6-5-7-13-36-38-33/h9-12,21,25-26,29,40H,5-8,13-20H2,1-4H3,(H,34,42)(H,37,41)/t25-,26+,29-/m1/s1
SMILES Code
O=C(N[C@H](C(N1[C@H](C(NCC2=CC=C(C3=C(C)N=CS3)C=C2)=O)C[C@@H](O)C1)=O)C(C)(C)C)COCCOCCCCCCN=[N+]=[N-]
Appearance
To be determined
Purity
>95% (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

Preparing Stock Solutions

The following data is based on the product molecular weight 657.83 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