WARNING: This product is for research use only, not for human or veterinary use.
Hodoodo CAT#: H463087
CAS#: unknown
Description: PB-WUT-01 is a novel calcineurin inhibitor in the C. albicans cells, enhancing susceptibility of the cells.
Hodoodo Cat#: H463087
Name: PB-WUT-01
CAS#: unknown
Chemical Formula: C22H22Br4N10O3
Exact Mass: 789.86
Molecular Weight: 794.101
Elemental Analysis: C, 33.28; H, 2.79; Br, 40.25; N, 17.64; O, 6.04
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Synonym: PB-WUT-01; PBWUT-01; PB WUT-01; PB-WUT 01; PB-WUT01;
IUPAC/Chemical Name: 1,3-dimethyl-7-(2-((1-(3-(perbromo-2H-benzo[d][1,2,3]triazol-2-yl)propyl)-1H-1,2,3-triazol-4-yl)methoxy)propyl)-3,7-dihydro-1H-purine-2,6-dione
InChi Key: KFYUYSCIXAEPNM-UHFFFAOYSA-N
InChi Code: InChI=1S/C22H22Br4N10O3/c1-11(7-34-10-27-20-19(34)21(37)33(3)22(38)32(20)2)39-9-12-8-35(31-28-12)5-4-6-36-29-17-15(25)13(23)14(24)16(26)18(17)30-36/h8,10-11H,4-7,9H2,1-3H3
SMILES Code: BrC1=C(Br)C(Br)=C(Br)C2=NN(CCCN3N=NC(COC(C)CN4C=NC(N(C)C(N5C)=O)=C4C5=O)=C3)N=C12
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: Soluble in DMSO
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:
Biological target: | |
In vitro activity: | |
In vivo activity: |
The following data is based on the product molecular weight 794.10 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.
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: | |
In vitro protocol: | |
In vivo protocol: |
1: Gizińska M, Staniszewska A, Kazek M, Koronkiewicz M, Kuryk Ł, Milner-Krawczyk M, Baran J, Borowiecki P, Staniszewska M. Antifungal polybrominated proxyphylline derivative induces Candida albicans calcineurin stress response in Galleria mellonella. Bioorg Med Chem Lett. 2020 Sep 12;30(23):127545. doi: 10.1016/j.bmcl.2020.127545. Epub ahead of print. PMID: 32931913.