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MedKoo Cat#: 128287 | Name: AH078

Description:

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

AH078 is a Casein Kinase Degrader. AH078 targets CK1δ and CK1ε with excellent selectivity over the highly related CK1α isoform. AH078 selectively degraded CK1δ and CK1ε with a DC50 of 200 nM. Characterization of AH078 revealed a VHL and Ubiquitin-dependent degradation mechanism.

Chemical Structure

AH078
AH078
CAS#N/A

Theoretical Analysis

MedKoo Cat#: 128287

Name: AH078

CAS#: N/A

Chemical Formula: C51H60F2N10O5S

Exact Mass: 962.4437

Molecular Weight: 963.16

Elemental Analysis: C, 63.60; H, 6.28; F, 3.95; N, 14.54; O, 8.31; S, 3.33

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
AH078; AH-078; AH 078
IUPAC/Chemical Name
(2R,4S)-1-((R)-2-(8-(4-fluoro-4-((4-(5-fluoropyridin-2-yl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1H-imidazol-1-yl)methyl)piperidin-1-yl)-8-oxooctanamido)-3,3-dimethylbutanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide
InChi Key
PWYJKWQDDHJXMJ-JMVXIWCISA-N
InChi Code
InChI=1S/C51H60F2N10O5S/c1-32-45(69-31-59-32)34-13-11-33(12-14-34)26-57-48(67)40-25-36(64)28-63(40)49(68)46(50(2,3)4)60-41(65)9-7-5-6-8-10-42(66)61-23-19-51(53,20-24-61)29-62-30-58-43(39-16-15-35(52)27-56-39)44(62)37-17-21-54-47-38(37)18-22-55-47/h11-18,21-22,27,30-31,36,40,46,64H,5-10,19-20,23-26,28-29H2,1-4H3,(H,54,55)(H,57,67)(H,60,65)/t36-,40+,46-/m0/s1
SMILES Code
FC1=CN=C(C2=C(C3=C(C=CN4)C4=NC=C3)N(CC5(CCN(C(CCCCCCC(N[C@H](C(C)(C)C)C(N6C[C@@H](O)C[C@@H]6C(NCC7=CC=C(C8=C(C)N=CS8)C=C7)=O)=O)=O)=O)CC5)F)C=N2)C=C1
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

Preparing Stock Solutions

The following data is based on the product molecular weight 963.16 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
1: Haag A, Němec V, Janovská P, Bartošíková J, Adhikari B, Müller J, Schwalm MP, Čada Š, Ohmayer U, Daub H, Kim Y, Born F, Wolf E, Bryja V, Knapp S. Development and Discovery of a Selective Degrader of Casein Kinases 1 δ/ε. J Med Chem. 2024 Dec 27. doi: 10.1021/acs.jmedchem.4c02201. Epub ahead of print. PMID: 39729064. 2: Wills RH, Habtemariam A, Lopez-Clavijo AF, Barrow MP, Sadler PJ, O'Connor PB. Insights into the binding sites of organometallic ruthenium anticancer compounds on peptides using ultra-high resolution mass spectrometry. J Am Soc Mass Spectrom. 2014 Apr;25(4):662-72. doi: 10.1007/s13361-013-0819-2. Epub 2014 Feb 1. PMID: 24488754.