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Chemical Structure| 127985-74-4 Chemical Structure| 127985-74-4

Structure of p-SCN-Bn-DOTA
CAS No.: 127985-74-4

Chemical Structure| 127985-74-4

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p-SCN-Bn-DOTA is a bifunctional chelating agent that chelates radionuclides and conjugates with monoclonal antibodies, used in tumor radioimmunotherapy research.

4.5 *For Research Use Only !

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Product Citations

Product Citations

Piyapan Suwattananuruk ; Sukanya Yaset ; Chanisa Chotipanich ; Angel Moldes-Anaya ; Rune Sundset ; Rodrigo Berzaghi , et al.

Abstract: Background: This study aimed to develop a novel positron emission tomography (PET) tracer, [68Ga]Ga-TD-01, for CXCR4 imaging. To achieve this goal, the molecular scafold of TIQ15 was tuned by conjugation with the DOTA chelator to make it suitable for 68Ga radiolabeling. Methods: A bifunctional chelator was prepared by conjugating the amine group of TIQ15 with p-NCS-Bz-DOTA, yielding TD-01, with a high yield (68.92%). TD-01 was then radiolabeled with 68Ga using 0.1 M ammonium acetate at 60 °C for 10 min. A 1-h dynamic small animal PET/MRI study of the labeled compound in GL261-luc2 tumor-bearing mice was performed, and brain tumor uptake was assessed. Blocking studies involved pre-administration of TIQ15 (10 mg/kg) 10 min before the PET proce-dure started. Results: [68Ga]Ga-TD-01 exhibited a radiochemical yield (RCY) of 36.33±1.50% (EOS), with a radiochemical purity >99% and a molar activity of 55.79±1.96 GBq/µmol (EOS). The radiotracer showed in vitro stability in PBS and human plasma for over 4 h. Biodistribution studies in healthy animals revealed favorable kinetics for subsequent PET pharmacokinetic modeling with low uptake in the brain and moderate uptake in lungs, intestines and spleen. Elimination could be assigned to a renal-hepatic pathway as showed by high uptake in kidneys, liver, and urinary bladder. Importantly, [68Ga]Ga-TD-01 uptake in glioblastoma (GBM)-bearing mice signifcantly decreased upon competition with TIQ15, with a baseline tumor-to-background ratios >2.5 (20 min p.i.), indicating high specifcity. Conclusion: The newly developed CXCR4 PET tracer, [68Ga]Ga-TD-01, exhibited a high binding inhibition for CXCR4, excellent in vitro stability, and favorable phar‑macokinetics, suggesting that the compound is a promising candidate for full in vivo characterization of CXCR4 expression in GBM, with potential for further development as a tool in cancer diagnosis.

Keywords: CXCR4 receptor ; Glioblastoma (GBM) ; 68Ga ; Bifunctional chelator (BFC) ; Positron emission tomography ; PET tracer

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Product Details of p-SCN-Bn-DOTA

CAS No. :127985-74-4
Formula : C24H33N5O8S
M.W : 551.61
SMILES Code : S=C=NC1=CC=C(C=C1)CC2CN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CCN2CC(O)=O
MDL No. :MFCD11112156

Safety of p-SCN-Bn-DOTA

GHS Pictogram:
Signal Word:Danger
Hazard Statements:H301-H315-H319-H334-H335
Precautionary Statements:P501-P261-P270-P271-P264-P280-P284-P302+P352-P342+P311-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P310+P330-P304+P340+P312-P403+P233-P405
Class:6.1
UN#:2811
Packing Group:

Isoform Comparison

Protocol

Bio Calculators
Preparing Stock Solutions 1mg 5mg 10mg

1 mM

5 mM

10 mM

1.81mL

0.36mL

0.18mL

9.06mL

1.81mL

0.91mL

18.13mL

3.63mL

1.81mL

Dissolving Methods
Please choose the appropriate dissolution scheme according to your animal administration guide.For the following dissolution schemes, clear stock solution should be prepared according to in vitro experiments, and then cosolvent should be added in turn:

in order to ensure the reliability of the experimental results, the clarified stock solution can be properly preserved according to the storage conditions; The working fluid for in vivo experiment is recommended to be prepared now and used on the same day;

The percentage shown in front of the following solvent refers to the volume ratio of the solvent in the final solution; If precipitation or precipitation occurs in the preparation process, it can be assisted by heating and/or ultrasound.
Protocol 1
Protocol 2
 

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