MedKoo Cat#: 122412 | Name: VIR250

Description:

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

VIR250 is a SARS-CoV-2 inhibitor

Chemical Structure

VIR250
VIR250
CAS#N/A

Theoretical Analysis

MedKoo Cat#: 122412

Name: VIR250

CAS#: N/A

Chemical Formula: C23H30N6O6S

Exact Mass: 518.1948

Molecular Weight: 518.59

Elemental Analysis: C, 53.27; H, 5.83; N, 16.21; O, 18.51; S, 6.18

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
VIR250;VIR 250 ;VIR-250
IUPAC/Chemical Name
methyl (4S,7S,E)-7-(aminomethyl)-4-(2-(benzo[d]thiazol-2-yl)ethyl)-2,5,8,11-tetraoxo-3,6,9,12-tetraazahexadec-14-en-16-oate
InChi Key
FIJIAKBBNLGTOY-DIYXLRBJSA-N
InChi Code
InChI=1S/C23H30N6O6S/c1-14(30)27-16(9-10-20-28-15-6-3-4-7-18(15)36-20)23(34)29-17(12-24)22(33)26-13-19(31)25-11-5-8-21(32)35-2/h3-8,16-17H,9-13,24H2,1-2H3,(H,25,31)(H,26,33)(H,27,30)(H,29,34)/b8-5+/t16-,17-/m0/s1
SMILES Code
CC(N[C@@H](CCC1=NC(C=CC=C2)=C2S1)C(N[C@@H](CN)C(NCC(NC/C=C/C(OC)=O)=O)=O)=O)=O
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 518.59 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: Sanachai K, Mahalapbutr P, Sanghiran Lee V, Rungrotmongkol T, Hannongbua S. In Silico Elucidation of Potent Inhibitors and Rational Drug Design against SARS-CoV-2 Papain-like Protease. J Phys Chem B. 2021 Dec 23;125(50):13644-13656. doi: 10.1021/acs.jpcb.1c07060. Epub 2021 Dec 14. PMID: 34904832; PMCID: PMC8691209. 2: Rut W, Lv Z, Zmudzinski M, Patchett S, Nayak D, Snipas SJ, El Oualid F, Huang TT, Bekes M, Drag M, Olsen SK. Activity profiling and structures of inhibitor- bound SARS-CoV-2-PLpro protease provides a framework for anti-COVID-19 drug design. bioRxiv [Preprint]. 2020 Apr 29:2020.04.29.068890. doi: 10.1101/2020.04.29.068890. Update in: Sci Adv. 2020 Oct 16;6(42): PMID: 32511411; PMCID: PMC7263558.