Physicochemical Properties
Molecular Formula | C4H6D6CLN5 |
Molecular Weight | 171.66 |
Exact Mass | 171.115 |
CAS # | 1185166-01-1 |
Related CAS # | Metformin hydrochloride;1115-70-4 |
PubChem CID | 45039707 |
Appearance | White to off-white solid powder |
Melting Point | 215-218°C |
LogP | 1.058 |
Hydrogen Bond Donor Count | 4 |
Hydrogen Bond Acceptor Count | 1 |
Rotatable Bond Count | 2 |
Heavy Atom Count | 10 |
Complexity | 132 |
Defined Atom Stereocenter Count | 0 |
SMILES | [2H]C([2H])([2H])N(C(=N)N=C(N)N)C([2H])([2H])[2H].Cl |
InChi Key | OETHQSJEHLVLGH-TXHXQZCNSA-N |
InChi Code | InChI=1S/C4H11N5.ClH/c1-9(2)4(7)8-3(5)6;/h1-2H3,(H5,5,6,7,8);1H/i1D3,2D3; |
Chemical Name | 3-(diaminomethylidene)-1,1-bis(trideuteriomethyl)guanidine;hydrochloride |
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 Note: Please store this product in a sealed and protected environment, avoid exposure to moisture. |
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
Targets | AMPK |
References |
[1]. Acute treatment with metformin improves cardiac function following NSC 37745 induced myocardial infarction in rats. Pharmacol Rep. 2012;64(6):1476-84. |
Solubility Data
Solubility (In Vitro) |
H2O : 50 mg/mL (291.27 mM) DMSO : 50 mg/mL (291.27 mM) |
Solubility (In Vivo) |
Solubility in Formulation 1: ≥ 2.08 mg/mL (12.12 mM) (saturation unknown) in 10% DMSO + 90% (20% SBE-β-CD in Saline) (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 20.8 mg/mL clear DMSO stock solution to 900 μL of 20% SBE-β-CD physiological saline solution and mix evenly. Preparation of 20% SBE-β-CD in Saline (4°C,1 week): Dissolve 2 g SBE-β-CD in 10 mL saline to obtain a clear solution. Solubility in Formulation 2: ≥ 2.08 mg/mL (12.12 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 20.8 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 | 5.8255 mL | 29.1273 mL | 58.2547 mL | |
5 mM | 1.1651 mL | 5.8255 mL | 11.6509 mL | |
10 mM | 0.5825 mL | 2.9127 mL | 5.8255 mL |