SMILES:
CNC(=O)C1=CC(=C(NC2=NC3=C(C(=N2)OC4CCCC4)C(=C[NH]3)C5=CC6=C(C=C5)N=C(C)O6)C=C1)OC
Chemical Structure
Check the
CC-671
product page for in-depth specifications, including solubility, stock solutions, MOA, and working concentrations.
| IUPAC Name | 4-[[4-cyclopentyloxy-5-(2-methyl-1,3-benzoxazol-6-yl)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]-3-methoxy-N-methylbenzamide | |
|---|---|---|
| CAS Number | 1618658-88-0 | |
| Molecular Formula |
C28H28N6O4 |
|
| Molecular Weight (MW) | 512.56 | |
| SMILES | CNC(=O)C1=CC(=C(NC2=NC3=C(C(=N2)OC4CCCC4)C(=C[NH]3)C5=CC6=C(C=C5)N=C(C)O6)C=C1)OC | |
| InChIKey | CWJLAVRXVFHDSJ-UHFFFAOYSA-N |
|
Concentration
Volume
Mass
|
|---|
Batch:
All in vitro solubility values are batch-tested experimental data (non-literature values).
| Solvent | Solubility & Note |
|---|---|
| DMSO |
100 mg/mL
(195.09 mM)
(Moisture-contaminated DMSO may reduce solubility. Use fresh, anhydrous DMSO. The recommended stock concentration is 10 mM in DMSO.) |
| Water | Insoluble |
| Ethanol | Insoluble |
| DMSO |
100 mg/mL
(195.09 mM)
(Moisture-contaminated DMSO may reduce solubility. Use fresh, anhydrous DMSO. The recommended stock concentration is 10 mM in DMSO.) |
| Water | Insoluble |
| Ethanol | 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.