NADPH → HCID 70655442, compound

Participants

Reaction Steps

(2R)-1,1,1-trifluoro-2-(4-((2S)-2-(2-methylpropyl)-4-(2-thiophenylsulfonyl)-1-piperazinyl)phenyl)-2-propanol; (2S)-1,1,1-trifluoro-2-(4-((2R)-2-(2-methylpropyl)-4-(2-thiophenylsulfonyl)-1-piperazinyl)phenyl)-2-propanol; (2S)-1,1,1-trifluoro-2-(4-((2S)-2-(2-methylpropyl)-4-(2-thiophenylsulfonyl)-1-piperazinyl)phenyl)-2-propanol. 1H NMR (400 MHz, CDCl3) δ 7.64-7.62 (m, 1H), 7.57-7.55 (m, 1H), 7.43-7.40 (d, J=8.8 Hz, 2H), 7.17-7.14 (m, 1H), 6.81-6.79 (d, J=8.8 Hz, 2H), 3.97-3.90 (m, 1H), 3.75-3.68 (m, 2H), 3.44-3.39 (m, 1H), 3.34-3.27 (m, 1H), 2.71-2.67 (m, 1H), 2.63-2.57 (m, 1H), 1.87-1.79 (m, 1H), 1.65-1.60 (m, 1H), 1.74 (s, 3H), 1.23-1.19 (m, 1H), 0.92-0.88 (m, 6H). m/z (ESI, +ve ion) 477.1 (M+H)+. GK-GKRP EC50 (NADPH-coupled)=0.655 μM; GK-GKRP EC50 (LC MS/MS)=1.02 μM.

Provenance & Evidence