MedKoo Cat#: 465892 | Name: PBF-999 HCl

Description:

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

PBF-999 is a A2AR antagonist in clinical trials for cancer immunotherapy.

Chemical Structure

PBF-999 HCl
PBF-999 HCl
CAS#PBF-999 HCl

Theoretical Analysis

MedKoo Cat#: 465892

Name: PBF-999 HCl

CAS#: PBF-999 HCl

Chemical Formula: C9H10BrCl2N7

Exact Mass: 293.0025

Molecular Weight: 367.03

Elemental Analysis: C, 29.45; H, 2.75; Br, 21.77; Cl, 19.32; N, 26.71

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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Synonym
PBF-999; PBF999; PBF 999;
IUPAC/Chemical Name
5-bromo-N4-(prop-2-yn-1-yl)-2-(1H-1,2,4-triazol-1-yl)pyrimidine-4,6-diamine dihydrochloride
InChi Key
WZDCTMUUXBGZRT-UHFFFAOYSA-N
InChi Code
InChI=1S/C9H8BrN7.2ClH/c1-2-3-13-8-6(10)7(11)15-9(16-8)17-5-12-4-14-17;;/h1,4-5H,3H2,(H3,11,13,15,16);2*1H
SMILES Code
NC1=C(Br)C(NCC#C)=NC(N2N=CN=C2)=N1.[H]Cl.[H]Cl
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 367.03 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