MedKoo Cat#: 555830 | Name: PTN57491
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Description:

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

PTN57491 is an key intermediate chemical to synthesize antiviral drugs remdesivir and GS441524. This product has no formal name at the moment. For the convenience of communication, a temporary code name was therefore proposed according to MedKoo Chemical Nomenclature (see web page: https://www.medkoo.com/page/naming).

Chemical Structure

PTN57491
PTN57491
CAS#1355357-49-1

Theoretical Analysis

MedKoo Cat#: 555830

Name: PTN57491

CAS#: 1355357-49-1

Chemical Formula: C33H31N5O4

Exact Mass: 561.2376

Molecular Weight: 561.64

Elemental Analysis: C, 70.57; H, 5.56; N, 12.47; O, 11.39

Price and Availability

Size Price Availability Quantity
100mg USD 950.00 2 Weeks
200mg USD 1,650.00 2 Weeks
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Related CAS #
No Data
Synonym
PTN57491; PTN-57491; PTN 57491; GS441524-intermediate; GS 441524-intermediate; GS-441524-intermediate; remdesivir-intermediate; Remdesivir related compound 5;
IUPAC/Chemical Name
(2R,3R,4R,5R)-2-(4-Aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-3,4-bis(benzyloxy)-5-((benzyloxy)methyl)tetrahydrofuran-2-carbonitrile
InChi Key
PJXBLWLWNWGFJO-TXLSGFARSA-N
InChi Code
InChI=1S/C33H31N5O4/c34-22-33(29-17-16-27-32(35)36-23-37-38(27)29)31(41-20-26-14-8-3-9-15-26)30(40-19-25-12-6-2-7-13-25)28(42-33)21-39-18-24-10-4-1-5-11-24/h1-17,23,28,30-31H,18-21H2,(H2,35,36,37)/t28-,30-,31-,33+/m1/s1
SMILES Code
N#C[C@@]1(C2=CC=C3C(N)=NC=NN32)O[C@H](COCC4=CC=CC=C4)[C@@H](OCC5=CC=CC=C5)[C@H]1OCC6=CC=CC=C6
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
>3 years if stored properly
Drug Formulation
This drug may be formulated in DMSO
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
Product Data
Biological target:
To be determined
In vitro activity:
To be determined
In vivo activity:
To be determined

Preparing Stock Solutions

The following data is based on the product molecular weight 561.64 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
Formulation protocol:
To be determined
In vitro protocol:
To be determined
In vivo protocol:
To be determined
1. Murphy BG, Perron M, Murakami E, Bauer K, Park Y, Eckstrand C, Liepnieks M, Pedersen NC. The nucleoside analog GS-441524 strongly inhibits feline infectious peritonitis (FIP) virus in tissue culture and experimental cat infection studies. Vet Microbiol. 2018 Jun;219:226-233. doi: 10.1016/j.vetmic.2018.04.026. Epub 2018 Apr 22. PMID: 29778200; PMCID: PMC7117434. 2. Yang K. What Do We Know About Remdesivir Drug Interactions? Clin Transl Sci. 2020 Sep;13(5):842-844. doi: 10.1111/cts.12815. Epub 2020 Jun 26. PMID: 32402130; PMCID: PMC7272915. 3. Advantages of the Parent Nucleoside GS-441524 over Remdesivir for Covid-19 Treatment Victoria C. Yan and Florian L. Muller ACS Medicinal Chemistry Letters 2020 11 (7), 1361-1366 DOI: 10.1021/acsmedchemlett.0c00316