Phenyl isocyanate → HCID 71226633, compound

Participants

Reaction Steps

1-((1R,2R)-2-((S)-1-(5-Nitropyrimidin-2-yl)piperidin-3-ylamino)cyclohexyl)-3-phenylurea (17.5 mg, 0.031 mmol, 51.5% yield) was synthesized as described in General Procedure F using phenyl isocyanate (7.15 mg, 0.060 mmol) and (1R,2R)—N1-((S)-1-(5-nitropyrimidin-2-yl)piperidin-3-yl)cyclohexane-1,2-diamine (32.9 mg, 0.060 mmol). Anal. Calcd. for C22H29N7O3 m/z 439.5, found: 440.4 (M+H)+; 1H NMR (400 MHz, CDCl3) δ ppm 10.25 (br. s., 1H), 8.90 (d, J=6.60 Hz, 1H), 8.78-8.59 (m, 2H), 7.23-7.123 (m, 4H), 6.98 (t, J=6.87 Hz, 1H), 6.56 (br. s., 1H), 4.27 (d, J=12.09 Hz, 1H), 4.12-3.92 (m, 2H), 3.88-3.73 (m, 1H), 3.64 (br. s., 1H), 3.21 (br. s., 1H), 3.02-2.77 (m, 3H), 2.20-2.00 (m, 2H), 1.92 (ddd, J=7.01, 3.44, 3.30 Hz, 1H), 1.80 (d, J=10.99 Hz, 2H), 1.63 (d, J=14.29 Hz, 3H), 1.35-1.11 (m, 2H).

Provenance & Evidence