MedKoo Cat#: 465546 | Name: YWN-00640

Description:

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

YWN-00640 is a novel inhibitor of PD-1/PD-L1 (IC50 value of 56.58 nM), dose-dependently promoting HepG2 cell death in a co-culture model of HepG2/hPD-L1 and Jurkat T cells, effectively inhibiting tumor growth (TGI of 76.4% at 90 mg/kg) in an immune checkpoint humanized mouse model with no obvious toxicity.

Chemical Structure

YWN-00640
YWN-00640
CAS#unknown

Theoretical Analysis

MedKoo Cat#: 465546

Name: YWN-00640

CAS#: unknown

Chemical Formula: C35H33ClF3NO5

Exact Mass: 639.1999

Molecular Weight: 640.10

Elemental Analysis: C, 65.68; H, 5.20; Cl, 5.54; F, 8.90; N, 2.19; O, 12.50

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.
Bulk Inquiry
Related CAS #
No Data
Synonym
YWN-00640; YWN00640; YWN 00640; PD-1/PD-L1 inhibitor CH1;
IUPAC/Chemical Name
(R)-1-(5-chloro-4-((2-methyl-[1,1'-biphenyl]-3-yl)methoxy)-2-((4-(trifluoromethoxy)benzyl)oxy)benzyl)piperidine-2-carboxylic acid
InChi Key
YWCCHIWRNJHZEW-WJOKGBTCSA-N
InChi Code
InChI=1S/C35H33ClF3NO5/c1-23-26(10-7-11-29(23)25-8-3-2-4-9-25)22-44-33-19-32(43-21-24-13-15-28(16-14-24)45-35(37,38)39)27(18-30(33)36)20-40-17-6-5-12-31(40)34(41)42/h2-4,7-11,13-16,18-19,31H,5-6,12,17,20-22H2,1H3,(H,41,42)/t31-/m1/s1
SMILES Code
O=C([C@@H]1N(CC2=CC(Cl)=C(OCC3=C(C)C(C4=CC=CC=C4)=CC=C3)C=C2OCC5=CC=C(OC(F)(F)F)C=C5)CCCC1)O
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 640.10 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