NADPH → HCID 66584065, compound

Participants

Reaction Steps

((2R)-4-(2-thiophenylsulfonyl)-1-(4-((1S)-2,2,2-trifluoro-1-hydroxy-1-methylethyl)phenyl)-2-piperazinyl)acetonitrile; ((2S)-4-(2-thiophenylsulfonyl)-1-(4-((1R)-2,2,2-trifluoro-1-hydroxy-1-methylethyl)phenyl)-2-piperazinyl)acetonitrile; ((2S)-4-(2-thiophenylsulfonyl)-1-(4-((1S)-2,2,2-trifluoro-1-hydroxy-1-methylethyl)phenyl)-2-piperazinyl)acetonitrile. 1H NMR (400 MHz, CDCl3) δ 7.68-7.66 (m, 1H), 7.62-7.60 (m, 1H), 7.48-7.46 (d, J=8.8 Hz, 2H), 7.19-7.17 (m, 1H), 6.87-6.85 (d, J=8.8 Hz, 2H), 4.11-4.04 (m, 2H), 3.89-3.78 (m, 2H), 3.48-3.41 (m, 2H), 3.27-3.20 (m, 1H), 2.77-2.72 (m, 1H), 2.69-2.61 (m, 1H), 1.74 (s, 3H). m/z (ESI, +ve ion) 460.1 (M+H)+. GK-GKRP EC50 (NADPH-coupled)=3.03 μM; GK-GKRP EC50 (LC MS/MS)=3.94 μM.

Provenance & Evidence