Physicochemical Properties
| Molecular Formula | C22H25N3O7 |
| Molecular Weight | 443.45 |
| Exact Mass | 443.169 |
| CAS # | 1211333-20-8 |
| PubChem CID | 46183972 |
| Appearance | Light green to yellow green solid powder |
| Density | 1.3±0.1 g/cm3 |
| Boiling Point | 593.4±50.0 °C at 760 mmHg |
| Flash Point | 312.7±30.1 °C |
| Vapour Pressure | 0.0±1.7 mmHg at 25°C |
| Index of Refraction | 1.594 |
| LogP | 3.65 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 8 |
| Heavy Atom Count | 32 |
| Complexity | 650 |
| Defined Atom Stereocenter Count | 0 |
| InChi Key | YDLUIXGYKWYMMC-UHFFFAOYSA-N |
| InChi Code | InChI=1S/C22H25N3O7/c1-6-29-13-30-15-7-9-17-14(11-15)12-18(31-17)16-8-10-19(23-20(16)25(27)28)24(5)21(26)32-22(2,3)4/h7-12H,6,13H2,1-5H3 |
| Chemical Name | tert-butyl N-[5-[5-(ethoxymethoxy)-1-benzofuran-2-yl]-6-nitropyridin-2-yl]-N-methylcarbamate |
| HS Tariff Code | 2934.99.9001 |
| Storage |
Powder-20°C 3 years 4°C 2 years In solvent -80°C 6 months -20°C 1 month |
| Shipping Condition | Room temperature (This product is stable at ambient temperature for a few days during ordinary shipping and time spent in Customs) |
Biological Activity
| ln Vitro | The amyloid-β imaging ligand AZD4694 Precursor has a strong affinity for amyloid-β plaques. When compared to other fluorinated amyloid-PET tracers, AZD4694 Precursor exhibits lesser white matter binding, making it a high affinity (Kd= 2.3 nM) radioligand for imaging amyloid-β plaques that facilitates easier visual reads[1]. |
| References |
[1]. Determining Amyloid-β Positivity Using 18F-AZD4694 PET Imaging. J Nucl Med. 2021;62(2):247-252. |
Solubility Data
| Solubility (In Vitro) | DMSO: 50 mg/mL (112.75 mM) |
| Solubility (In Vivo) |
Solubility in Formulation 1: 2.5 mg/mL (5.64 mM) in 10% DMSO + 40% PEG300 +5% Tween-80 + 45% Saline (add these co-solvents sequentially from left to right, and one by one), suspension solution; with sonication. For example, if 1 mL of working solution is to be prepared, you can add 100 μL of 25.0 mg/mL clear DMSO stock solution to 400 μL PEG300 and mix evenly; then add 50 μL Tween-80 + to the above solution and mix evenly; then add 450 μL normal saline to adjust the volume to 1 mL. Preparation of saline: Dissolve 0.9 g of sodium chloride in 100 mL ddH₂ O to obtain a clear solution.  (Please use freshly prepared in vivo formulations for optimal results.) |
| Preparing Stock Solutions | 1 mg | 5 mg | 10 mg | |
| 1 mM | 2.2550 mL | 11.2752 mL | 22.5505 mL | |
| 5 mM | 0.4510 mL | 2.2550 mL | 4.5101 mL | |
| 10 mM | 0.2255 mL | 1.1275 mL | 2.2550 mL |