MedKoo Cat#: 208111 | Name: DI-1548

Description:

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

DI-1548 is a novel potent, selective and covalent DCN1 inhibitor. DI-1548 is highly potent and effective in inhibition of the neddylation of cullin 3 in cells with different tissue types, such as osteosarcoma U2OS cell line , immortalized THLE2 liver cells (Fig. 6b), breast cancer MDA-MB-231 cell line, esophageal cancer KYSE70 cell line , and colon cancer HCT116 cell lines. DI-1548 at concentrations as low as 0.3 nM significantly reduce the level of neddylated cullin 3 and achieve profound inhibition of the neddylation of cullin 3 at 1–3 nM.

Chemical Structure

DI-1548
CAS#2247060-97-3

Theoretical Analysis

MedKoo Cat#: 208111

Name: DI-1548

CAS#: 2247060-97-3

Chemical Formula: C32H47N5O4S

Exact Mass: 597.3349

Molecular Weight: 597.82

Elemental Analysis: C, 64.29; H, 7.92; N, 11.72; O, 10.70; S, 5.36

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 #
Synonym
DI-1548; DI1548; DI 1548
IUPAC/Chemical Name
N-((S)-2-cyclohexyl-2-((S)-3-(6-isopropylbenzo[d]thiazol-2-yl)-2-propionamidopropanamido)ethyl)-2-(morpholinomethyl)acrylamide
InChi Key
VHEFAXHJOOQBTB-RRPNLBNLSA-N
InChi Code
InChI=1S/C32H47N5O4S/c1-5-29(38)34-26(18-30-35-25-12-11-24(21(2)3)17-28(25)42-30)32(40)36-27(23-9-7-6-8-10-23)19-33-31(39)22(4)20-37-13-15-41-16-14-37/h11-12,17,21,23,26-27H,4-10,13-16,18-20H2,1-3H3,(H,33,39)(H,34,38)(H,36,40)/t26-,27+/m0/s1
SMILES Code
C=C(C(NC[C@@H](NC([C@H](CC1=NC2=C(C=C(C(C)C)C=C2)S1)NC(CC)=O)=O)C3CCCCC3)=O)CN4CCOCC4
Appearance
Solid powder
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 597.82 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. Zhou H, Lu J, Chinnaswamy K, Stuckey JA, Liu L, McEachern D, Yang CY, Bernard D, Shen H, Rui L, Sun Y, Wang S. Selective inhibition of cullin 3 neddylation through covalent targeting DCN1 protects mice from acetaminophen-induced liver toxicity. Nat Commun. 2021 May 11;12(1):2621. doi: 10.1038/s41467-021-22924-4. PMID: 33976147; PMCID: PMC8113459.