GPR84 antagonist 2

• CAT Number: I044139
• CAS Number: 2244269-74-5
• Molecular Formula: C28H16Cl2NaO4PS2
• Molecular Weight: 605.42
• Purity: ≥95%
• Synonyms: sodium;bis(4-chlorobenzo[b][1]benzothiepin-6-yl) phosphate
• InChI: InChI=1S/C28H17Cl2O4PS2.Na/c29-21-9-5-13-27-19(21)15-23(17-7-1-3-11-25(17)36-27)33-35(31,32)34-24-16-20-22(30)10-6-14-28(20)37-26-12-4-2-8-18(24)26;/h1-16H,(H,31,32);/q;+1/p-1
• InChIKey: JFIDCMUEKCPJLL-UHFFFAOYSA-M
• SMILES: C1=CC=C2C(=C1)C(=CC3=C(S2)C=CC=C3Cl)OP(=O)([O-])OC4=CC5=C(C=CC=C5Cl)SC6=CC=CC=C64.[Na+]

GPR84 antagonist 2 (compound 33) is a potent, selective, and orally active GPR84 antagonist (IC50=8.95 nM). GPR84 antagonist 2 shows improved potency in the calcium mobilization assay and the ability to inhibit the chemotaxis of neutrophils and macrophages upon GPR84 activation. GPR84 antagonist 2 has the potential for the research of ulcerative colitis[1].

Reference

[1]. Chen LH, et al. Phosphodiesters as GPR84 Antagonists for the Treatment of Ulcerative Colitis. J Med Chem. 2022;65(5):3991-4006.
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