
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 296280-56-3 |
| Catalog No. | 2A-2182267 |
| Chinese Name | S26131 |
| Molecular Formula | C31H34O4N2 |
| Molecular Weight | 498.62 |
| Density | 1.168±0.06 g/cm3(Predicted) |
| Boiling Point | 804.6±65.0 °C(Predicted) |
| Storage Condition | 2-8°C |
| Application | S26131 (compound 5) is a highly potent and selective MT1 melatonin ligand. Ki values for MT1 and MT2 were 0.5 and 112 nM, respectively. S26131 behaves as a MT1 and MT2 antagonist. |
| PubChem ID | 14835529 |
| MDL Number | MFCD16628064 |
| SMILES | CC(=O)NCCc1cccc2ccc(OCCCOc3ccc4cccc(CCNC(C)=O)c4c3)cc12 |
| InChI | InChI=1S/C31H34N2O4/c1-22(34)32-16-14-26-8-3-6-24-10-12-28(20-30(24)26)36-18-5-19-37-29-13-11-25-7-4-9-27(31(25)21-29)15-17-33-23(2)35/h3-4,6-13,20-21H,5,14-19H2,1-2H3,(H,32,34)(H,33,35) |
| InChI Key | NSXBZYDTTKLTOH-UHFFFAOYSA-N |
| Transport Info | Product name: S26131 |
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