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MRL-871
AOB0444
CAS No: 1392809-08-3
Chemical Name: 4-[1-[2-Chloro-6-(trifluoromethyl)benzoyl]-1H-indazol-3-yl]-benzoic acid
1979 Items
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 |
Overview
Novel RORγt inhibitor, binding to a previously unidentified allosteric pocket in the RORγt LBD
Chemical Properties
| Molecular Formula | C22H12ClF3N2O3 |
| Molecular Weight | 444.79 |
| CAS Numbers | 1392809-08-3 |
| Solubility | DMSO |
| Purity | 98% by HPLC |
| 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 |
Storage and Handling
0°C (short term), -20°C (long term), desiccated
Synonyms
MRL-871; MRL 871; MRL871
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
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