Orexin receptor antagonist 3

• CAT Number: I044685
• CAS Number: 1293282-55-9
• Molecular Formula: C21H22N8O3
• Molecular Weight: 434.45
• Purity: ≥95%
• Synonyms: [2-(4,6-dimethylpyrimidin-2-yl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-[2-nitro-6-(triazol-2-yl)phenyl]methanone
• InChI: InChI=1S/C21H22N8O3/c1-13-8-14(2)25-21(24-13)27-11-15-9-26(10-16(15)12-27)20(30)19-17(28-22-6-7-23-28)4-3-5-18(19)29(31)32/h3-8,15-16H,9-12H2,1-2H3
• InChIKey: MPDQVXKSEUGRGO-UHFFFAOYSA-N
• SMILES: CC1=CC(=NC(=N1)N2CC3CN(CC3C2)C(=O)C4=C(C=CC=C4[N+](=O)[O-])N5N=CC=N5)C

Orexin receptor antagonist 3 (example 216) is an orexin receptor antagonist, which is extracted from the patent WO2011050198A1[1].

Reference

[1]. Wenying Chai, et al. Disubstituted octahy – dropyrrolo [3,4-c] pyrroles as orexin receptor modulators. WO2011050198A1.