Physicochemical Properties
| Molecular Formula | C16H20N2O2S2 |
| Molecular Weight | 336.46 |
| Exact Mass | 336.096 |
| CAS # | 1062271-24-2 |
| PubChem CID | 18191179 |
| Appearance | Light yellow to yellow solid powder |
| Density | 1.3±0.1 g/cm3 |
| Boiling Point | 502.6±60.0 °C at 760 mmHg |
| Flash Point | 257.8±32.9 °C |
| Vapour Pressure | 0.0±1.3 mmHg at 25°C |
| Index of Refraction | 1.633 |
| LogP | 3.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Heavy Atom Count | 22 |
| Complexity | 457 |
| Defined Atom Stereocenter Count | 0 |
| InChi Key | IRGYSXZCDAWOOC-UHFFFAOYSA-N |
| InChi Code | InChI=1S/C16H20N2O2S2/c1-13-9-10-16(21-13)22(19,20)17-14-7-3-4-8-15(14)18-11-5-2-6-12-18/h3-4,7-10,17H,2,5-6,11-12H2,1H3 |
| Chemical Name | 5-methyl-N-(2-piperidin-1-ylphenyl)thiophene-2-sulfonamide |
| Synonyms | MK683; MK6 83; MK6-83 |
| 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
| ln Vitro | MK6-83 does not show enough cytotoxicity between 0.2 and 30 μM [1]. When it comes to fibroblast lysosomes isolated from cells expressing R403C or V446L, MK6-83 seems to be much more powerful than when it comes to cells isolated from TRPML1 −/− cells [1]. |
| Cell Assay |
Cell viability assay[1]. Cell Types: Lysosomes isolated from fibroblast cell lines of MLIV patients carrying F408D, R403C or V446L mutations[1]. Tested Concentrations: 0-10μM. Incubation Duration: 24 hrs (hours). Experimental Results: Effective on fibroblast lysosomes isolated from R403C or V446L expressing cells. There was no significant effect on lysosomes isolated from TRPML1-/- fibroblasts. |
| References |
[1]. A Small Molecule Restores Function to TRPML1 Mutant Isoforms Responsible for Mucolipidosis Type IV. Nat Commun. 2014 Aug 14;5:4681. |
Solubility Data
| Solubility (In Vitro) | DMSO : ~25 mg/mL (~74.30 mM) |
| Solubility (In Vivo) |
Solubility in Formulation 1: ≥ 2.5 mg/mL (7.43 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 (7.43 mM) in 10% DMSO + 90% Corn Oil (add these co-solvents sequentially from left to right, and one by one), suspension solution; with ultrasonication. 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 | 2.9721 mL | 14.8606 mL | 29.7212 mL | |
| 5 mM | 0.5944 mL | 2.9721 mL | 5.9442 mL | |
| 10 mM | 0.2972 mL | 1.4861 mL | 2.9721 mL |