CAS No. 1338780-86-1
Batch:
Purity:99.24
Chemical Structure
Check the
AU1235
product page for in-depth specifications, including solubility, stock solutions, MOA, and working concentrations.
| IUPAC Name | 1-(1-adamantyl)-3-(2,3,4-trifluorophenyl)urea | |
|---|---|---|
| CAS Number | 1338780-86-1 | |
| Molecular Formula |
C17H19F3N2O |
|
| Molecular Weight (MW) | 324.34 | |
| SMILES | C1C2CC3CC1CC(C2)(C3)NC(=O)NC4=C(C(=C(C=C4)F)F)F | |
| InChIKey | PYDHHHKUANVSJV-UHFFFAOYSA-N |
AU1235 is an adamantyl urea derivative and a potent inhibitor of the Mycobacterium tuberculosis membrane protein MmpL3. By targeting MmpL3, AU1235 disrupts the translocation of trehalose monomycolate across the bacterial inner membrane, thereby blocking mycolic acid incorporation into the outer envelope. This inhibition compromises mycobacterial cell wall integrity, resulting in severe growth inhibition and bacterial death. [1]
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Concentration
Volume
Mass
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Batch:
All in vitro solubility values are batch-tested experimental data (non-literature values).
| Solvent | Solubility & Note |
|---|---|
| Ethanol | 65 mg/mL |
| DMSO |
10 mg/mL
(30.83 mM)
(Moisture-contaminated DMSO may reduce solubility. Use fresh, anhydrous DMSO. The recommended stock concentration is 10 mM in DMSO.) |
| Water | Insoluble |
Q: Why does a DMSO stock precipitate in media/saline?
A: It is caused by unheated aqueous media (supersaturation), local solvent shock, or incorrect mixing sequence.
How to fix it?
- Preheat media/saline to 37°C.
- Mix rapidly (pipette/vortex) upon addition.
- For complex mixes, always add the aqueous phase last.
- Re-dissolve minor precipitates with a 37°C water bath and sonication (≤30 min).
Note: Technical data last updated: Sep 1, 2026.