GLP-1R Antagonist 1 is a novel, non-competitive, orally bioavailable, and brain penetrant antagonist of glucagon-like peptide 1 receptor (GLP-1R) with an IC50 of 650 nM.
Physicochemical Properties
| Molecular Formula | C16H11CLF6N4O2 |
| Molecular Weight | 440.727563142776 |
| Exact Mass | 440.047 |
| CAS # | 488097-06-9 |
| PubChem CID | 1941609 |
| Appearance | Typically exists as solid at room temperature |
| LogP | 2.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 1 |
| Heavy Atom Count | 29 |
| Complexity | 784 |
| Defined Atom Stereocenter Count | 0 |
| InChi Key | MFEIZMHODFOWAT-UHFFFAOYSA-N |
| InChi Code | InChI=1S/C16H11ClF6N4O2/c1-26-11-9(12(28)27(2)13(26)29)14(15(18,19)20,16(21,22)23)25-10(24-11)7-3-5-8(17)6-4-7/h3-6H,1-2H3,(H,24,25) |
| Chemical Name | 7-(4-chlorophenyl)-1,3-dimethyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione |
| 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
Solubility Data
| Solubility (In Vitro) | DMSO : ~100 mg/mL (~226.90 mM) |
| Solubility (In Vivo) |
Solubility in Formulation 1: ≥ 2.5 mg/mL (5.67 mM) (saturation unknown) in 10% DMSO + 90% Corn Oil (add these co-solvents sequentially from left to right, and one by one), clear solution. 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 900 μL of corn oil and mix evenly. (Please use freshly prepared in vivo formulations for optimal results.) |
| Preparing Stock Solutions | 1 mg | 5 mg | 10 mg | |
| 1 mM | 2.2690 mL | 11.3448 mL | 22.6896 mL | |
| 5 mM | 0.4538 mL | 2.2690 mL | 4.5379 mL | |
| 10 mM | 0.2269 mL | 1.1345 mL | 2.2690 mL |