NADPH → HCID 66582320, compound

Participants

Reaction Steps

(2S)-2-(4-((2R)-2-(2,5-dichlorophenyl)-4-(2-thiophenylsulfonyl)-1-piperazinyl)phenyl)-1,1,1-trifluoro-2-propanol; (2R)-2-(4-((2S)-2-(2,5-dichlorophenyl)-4-(2-thiophenylsulfonyl)-1-piperazinyl)phenyl)-1,1,1-trifluoro-2-propanol; (2R)-2-(4-((2R)-2-(2,5-dichlorophenyl)-4-(2-thiophenylsulfonyl)-1-piperazinyl)phenyl)-1,1,1-trifluoro-2-propanol. 1H NMR (300 MHz, CDCl3) δ 7.63 (d, J=5.0 Hz, 1H), 7.55 (dd, J=3.65, 1.0 Hz, 1H), 7.36 (d, J=8.5 Hz, 2H), 7.29 (d, J=1.8 Hz, 1H), 7.24 (s, 1H), 7.14 (dd, J=4.9, 3.9 Hz, 1H), 7.08 (dd, J=8.5, 2.5 Hz, 1H), 6.85 (d, J=8 62 Hz, 2H), 4.84 (dd, J=9.0, 3.4 Hz, 1H), 3.73-3.90 (m, 2H), 3.60 (d, J=12.3 Hz, 1H), 3.19-3.31 (m, 1H), 3.00-3.11 (m, 1H), 2.59-2.71 (m, 1H), 1.68 (d, J=3.5 Hz, 3H). m/z (ESI, +ve ion) 586.8 (M+Na)+. GK-GKRP EC50 (NADPH-coupled)=2.64 μM; GK-GKRP EC50 (LC MS/MS)=1.96 μM.

Provenance & Evidence