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View larger MRL-871
AOB0444
CAS No: 1392809-08-3
Chemical Name: 4-[1-[2-Chloro-6-(trifluoromethyl)benzoyl]-1H-indazol-3-yl]-benzoic acid
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Quantity Discount Table - Order More To Get More Price Discount
| Quantity | mg | Unit Price ($/mg or $/Unit) | Final Price |
|---|---|---|---|
| 1 | 5 | $58.65 | Total: $293.25 |
| 1 | 10 | $49.68 | Total: $496.80 |
| 1 | 25 | $42.09 | Total: $1,052.25 |
| 1 | 50 | $35.88 | Total: $1,794.00 |
| 1 | 100 | $31.05 | Total: $3,105.00 |
Data sheet
| Molecular Formula | C22H12ClF3N2O3 |
| Molecular Weight | 444.79 |
| CAS Numbers | 1392809-08-3 |
| Storage Condition | 0°C (short term), -20°C (long term), desiccated |
| Solubility | DMSO |
| Purity | 98% by HPLC |
| Synonym | MRL-871; MRL 871; MRL871 |
| IUPAC/Chemical Name | 4-[1-[2-Chloro-6-(trifluoromethyl)benzoyl]-1H-indazol-3-yl]-benzoic acid |
| InChl Key | DANLZOIRUUHIIX-UHFFFAOYSA-N |
| InChl Code | InChI=1S/C22H12ClF3N2O3/c23-16-6-3-5-15(22(24,25)26)18(16)20(29)28-17-7-2-1-4-14(17)19(27-28)12-8-10-13(11-9-12)21(30)31/h1-11H,(H,30,31) |
| SMILES Code | O=C(O)C1=CC=C(C2=NN(C(C3=C(C(F)(F)F)C=CC=C3Cl)=O)C4=C2C=CC=C4)C=C1 |
| References | Scheepstra M, Leysen S, van Almen GC, Miller JR, Piesvaux J, Kutilek V, van Eenennaam H, Zhang H, Barr K, Nagpal S, Soisson SM, Kornienko M, Wiley K, Elsen N, Sharma S, Correll CC, Trotter BW, van der Stelt M, Oubrie A, Ottmann C, Parthasarathy G, Brunsveld L. Identification of an allosteric binding site for RORγt inhibition. Nat Commun. 2015 Dec 7;6:8833. doi: 10.1038/ncomms9833. PubMed PMID: 26640126; PubMed Central PMCID: PMC4686831 |
More info
Novel RORγt inhibitor, binding to a previously unidentified allosteric pocket in the RORγt LBD
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