MedKoo Cat#: 126973 | Name: LLC-355

Description:

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

LLC-355 is an Autophagy-Tethering Compound for the Degradation of Discoidin Domain Receptor 1. LLC355 efficiently degraded DDR1 protein with a DC50 value of 150.8 nM in non-small cell lung cancer NCI-H23 cells. Mechanistic studies revealed LLC355 to induce DDR1 degradation via lysosome-mediated autophagy. LLC355 potently suppressed cancer cell tumorigenicity, migration, and invasion

Chemical Structure

LLC-355
LLC-355
CAS#N/A

Theoretical Analysis

MedKoo Cat#: 126973

Name: LLC-355

CAS#: N/A

Chemical Formula: C63H64ClF3N10O5

Exact Mass: 1132.4702

Molecular Weight: 1133.72

Elemental Analysis: C, 66.74; H, 5.69; Cl, 3.13; F, 5.03; N, 12.35; O, 7.06

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
LLC-355; LLC355; LLC 355
IUPAC/Chemical Name
(R)-N-(3-((4-(2-(2-((3-(N-(1-(3-benzyl-7-chloro-4-oxo-3,4-dihydroquinazolin-2-yl)-2-methylpropyl)-4-methylbenzamido)propyl)amino)-2-oxoethoxy)ethyl)piperazin-1-yl)methyl)-5-(trifluoromethyl)phenyl)-4-ethyl-3-(pyrazolo[1,5-a]pyrimidin-6-ylethynyl)benzamide
InChi Key
XJGVJBUWKZBRTR-QPUWJJAWSA-N
InChi Code
InChI=1S/C63H64ClF3N10O5/c1-5-47-18-19-50(34-49(47)17-14-45-37-69-56-22-24-70-77(56)40-45)60(79)71-53-33-46(32-51(35-53)63(65,66)67)38-74-28-26-73(27-29-74)30-31-82-41-57(78)68-23-9-25-75(61(80)48-15-12-43(4)13-16-48)58(42(2)3)59-72-55-36-52(64)20-21-54(55)62(81)76(59)39-44-10-7-6-8-11-44/h6-8,10-13,15-16,18-22,24,32-37,40,42,58H,5,9,23,25-31,38-39,41H2,1-4H3,(H,68,78)(H,71,79)/t58-/m1/s1
SMILES Code
CCC(C=CC(C(NC1=CC(CN2CCN(CCOCC(NCCCN(C(C3=CC=C(C)C=C3)=O)[C@@H](C4=NC5=CC(Cl)=CC=C5C(N4CC6=CC=CC=C6)=O)C(C)C)=O)CC2)=CC(C(F)(F)F)=C1)=O)=C7)=C7C#CC8=CN9N=CC=C9N=C8
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 1,133.72 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
Liu L, Zhao L, Yang L, Chai M, Liu Z, Ma N, Wang Y, Wu Q, Guo J, Zhou F, Huang W, Ren X, Wang J, Ding M, Wang Z, Ding K. Discovery of LLC355 as an Autophagy-Tethering Compound for the Degradation of Discoidin Domain Receptor 1. J Med Chem. 2024 May 10. doi: 10.1021/acs.jmedchem.4c00162. Epub ahead of print. PMID: 38730324.