Physicochemical Properties
Molecular Formula | C25H39CLN2O |
Molecular Weight | 419.04 |
Exact Mass | 418.275 |
Elemental Analysis | C, 71.66; H, 9.38; Cl, 8.46; N, 6.69; O, 3.82 |
CAS # | 1055-55-6 |
Related CAS # | 1055-55-6 (HCl);3748-77-4; |
PubChem CID | 13985 |
Appearance | Solid powder |
Density | 0.98g/cm3 |
Boiling Point | 495ºC at 760mmHg |
Flash Point | 253.1ºC |
Vapour Pressure | 3.6E-11mmHg at 25°C |
LogP | 7.928 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 14 |
Heavy Atom Count | 29 |
Complexity | 417 |
Defined Atom Stereocenter Count | 0 |
SMILES | Cl.CCCCCCOC1=CC=C(C(N(CCCC)CCCC)=N)C2=CC=CC=C12 |
InChi Key | PBYJDHRFPFHVKZ-UHFFFAOYSA-N |
InChi Code | InChI=1S/C25H38N2O.ClH/c1-4-7-10-13-20-28-24-17-16-23(21-14-11-12-15-22(21)24)25(26)27(18-8-5-2)19-9-6-3;/h11-12,14-17,26H,4-10,13,18-20H2,1-3H3;1H |
Chemical Name | 1-Naphthalenecarboximidamide, N,N-dibutyl-4-(hexyloxy)-, monohydrochloride |
Synonyms | Bunamidine hydrochloride; Bunamidine HCl; BW62415; BW-62415; BW 62415; Scolaban |
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 (e.g. under nitrogen), avoid exposure to moisture and light. |
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 | [1]. Gemmell MA, et al. Treatment of Echinococcus granulosus and Taenia hydatigena in dogs with bunamidine hydroxynaphthoate in a prepared food. Res Vet Sci. 1974;16(1):85-88. |
Solubility Data
Solubility (In Vitro) | DMSO : 33.33 mg/mL (79.54 mM) |
Solubility (In Vivo) |
Solubility in Formulation 1: ≥ 1.67 mg/mL (3.99 mM) (saturation unknown) in 10% DMSO + 40% PEG300 + 5% Tween80 + 45% 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 16.7 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. Solubility in Formulation 2: ≥ 1.67 mg/mL (3.99 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 16.7 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 3: ≥ 1.67 mg/mL (3.99 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 16.7 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 | 2.3864 mL | 11.9320 mL | 23.8641 mL | |
5 mM | 0.4773 mL | 2.3864 mL | 4.7728 mL | |
10 mM | 0.2386 mL | 1.1932 mL | 2.3864 mL |