MedKoo Cat#: 130501 | Name: Aß Aggregation Inhibitor DS2

Description:

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

Aß aggregation inhibitor DS2 is an inhibitor of Aß aggregation with an IC50 value of 2.43 ± 0.05 μM.

Chemical Structure

Aß Aggregation Inhibitor DS2
CAS#Aß aggregation inhibitor DS2

Theoretical Analysis

MedKoo Cat#: 130501

Name: Aß Aggregation Inhibitor DS2

CAS#: Aß aggregation inhibitor DS2

Chemical Formula: C36H41F6N9O5

Exact Mass: 793.3135

Molecular Weight: 793.77

Elemental Analysis: C, 54.47; H, 5.21; F, 14.36; N, 15.88; O, 10.08

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
AB aggregation inhibitor DS2, Aß-Ag-In-DS2, Aß Ag In DS2, Aß aggregation inhibitor-DS2, AB-Ag-In-DS2, AB Ag In DS2, AB aggregation inhibitor-DS2
IUPAC/Chemical Name
Ac-(2,2-bis((2-trifluoromethylphenyl-1H-1,2,3-triazol-4-yl)methyl))Gly-Leu-Val-OMe
InChi Key
JJVWDSVIEFHRDW-FIBWVYCGSA-N
InChi Code
InChI=1S/C36H41F6N9O5/c1-20(2)15-27(31(53)44-30(21(3)4)32(54)56-6)43-33(55)34(45-22(5)52,16-23-18-50(48-46-23)28-13-9-7-11-25(28)35(37,38)39)17-24-19-51(49-47-24)29-14-10-8-12-26(29)36(40,41)42/h7-14,18-21,27,30H,15-17H2,1-6H3,(H,43,55)(H,44,53)(H,45,52)/t27-,30-/m0/s1
SMILES Code
FC(F)(F)C1=CC=CC=C1N2C=C(CC(NC(C)=O)(C(N[C@@H](CC(C)C)C(N[C@@H](C(C)C)C(OC)=O)=O)=O)CC3=CN(C4=C(C(F)(F)F)C=CC=C4)N=N3)N=N2
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 793.77 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. Mann S, Kaur A, Kaur A, Priyadarshi N, Goyal B, Singhal NK, Goyal D. Triazole-Peptide Conjugate as a Modulator of Aβ-Aggregation, Metal-Mediated Aβ-Aggregation, and Cytotoxicity. ACS Chem Neurosci. 2023 May 3;14(9):1631-1645. doi: 10.1021/acschemneuro.3c00041. Epub 2023 Apr 11. PMID: 37040092.