Physicochemical Properties
| Molecular Formula | C11H18N2O3S |
| Molecular Weight | 258.3372 |
| Exact Mass | 258.103 |
| CAS # | 97-35-8 |
| PubChem CID | 66804 |
| Appearance | White to off-white solid powder |
| Density | 1.2±0.1 g/cm3 |
| Boiling Point | 410.6±55.0 °C at 760 mmHg |
| Melting Point | 102-105°C |
| Flash Point | 202.1±31.5 °C |
| Vapour Pressure | 0.0±1.0 mmHg at 25°C |
| Index of Refraction | 1.547 |
| LogP | 1.65 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Heavy Atom Count | 17 |
| Complexity | 322 |
| Defined Atom Stereocenter Count | 0 |
| SMILES | O=S(N(CC)CC)(C1C=C(N)C(OC)=CC=1)=O |
| InChi Key | WBGVVXSCGNGJFL-UHFFFAOYSA-N |
| InChi Code | InChI=1S/C11H18N2O3S/c1-4-13(5-2)17(14,15)9-6-7-11(16-3)10(12)8-9/h6-8H,4-5,12H2,1-3H3 |
| Chemical Name | 3-amino-N,N-diethyl-4-methoxybenzenesulfonamide |
| 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 |
[1]. Second-and third-harmonic generation of Nd: glass laser in fast red ITR organic crystal fiber. Japanese Journal of Applied Physics. 1998. [2]. A highly fluorescent simultaneous azo dye technique for demonstration of nonspecific alkaline phosphatase activity. J Histochem Cytochem. 1990 Mar;38(3):437-42. |
Solubility Data
| Solubility (In Vitro) | DMSO : ~100 mg/mL (~387.09 mM) |
| Solubility (In Vivo) |
Solubility in Formulation 1: ≥ 2.5 mg/mL (9.68 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 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. Solubility in Formulation 2: ≥ 2.5 mg/mL (9.68 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 25.0 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: ≥ 2.5 mg/mL (9.68 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 | 3.8709 mL | 19.3543 mL | 38.7087 mL | |
| 5 mM | 0.7742 mL | 3.8709 mL | 7.7417 mL | |
| 10 mM | 0.3871 mL | 1.9354 mL | 3.8709 mL |