CDPPB is a novel, potent, selective and brain penetrant mGluR5 positive allosteric modulator. CDPPB has been shown to have positive therapeutic effects for cognitive deficits in schizophrenia and pathology in Huntington's disease, without stimulating to evoke seizures. CDPPB as well as other PAM's have potential to be nootropic drugs that enhance learning and cognitive processes, including with respect to ASD.
Physicochemical Properties
| Molecular Formula | C23H16N4O |
| Molecular Weight | 364.39934 |
| Exact Mass | 364.132 |
| CAS # | 781652-57-1 |
| Related CAS # | 781652-57-1; |
| PubChem CID | 11245456 |
| Appearance | White to off-white solid powder |
| Density | 1.203g/cm3 |
| Boiling Point | 523.277ºC at 760 mmHg |
| Flash Point | 270.268ºC |
| Index of Refraction | 1.655 |
| LogP | 4.736 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 4 |
| Heavy Atom Count | 28 |
| Complexity | 572 |
| Defined Atom Stereocenter Count | 0 |
| InChi Key | BKUIZWILNWHFHD-UHFFFAOYSA-N |
| InChi Code | InChI=1S/C23H16N4O/c24-16-17-8-7-11-19(14-17)23(28)25-22-15-21(18-9-3-1-4-10-18)26-27(22)20-12-5-2-6-13-20/h1-15H,(H,25,28) |
| Chemical Name | 3-cyano-N-(2,5-diphenylpyrazol-3-yl)benzamide |
| 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
| References | Doria JG, de Souza JM, Andrade JN, Rodrigues HA, Guimaraes IM, Carvalho TG, Guatimosim C, Dobransky T, Ribeiro FM. The mGluR5 positive allosteric modulator, CDPPB, ameliorates pathology and phenotypic signs of a mouse model of Huntington's disease. Neurobiol Dis. 2015 Jan;73:163-73. |
Solubility Data
| Solubility (In Vitro) | DMSO : ~100 mg/mL (~274.42 mM) |
| Solubility (In Vivo) |
Solubility in Formulation 1: ≥ 5 mg/mL (13.72 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 50.0 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 | 2.7442 mL | 13.7212 mL | 27.4424 mL | |
| 5 mM | 0.5488 mL | 2.7442 mL | 5.4885 mL | |
| 10 mM | 0.2744 mL | 1.3721 mL | 2.7442 mL |