(S)-2-amino-3-(benzyloxy)-N-(4-(4-fluorophenoxy)phenyl)propanamide → (S)-2-(3-(3,5-dimethylisoxazol-4-yl)ureido)-3-benzyloxy-N-(4-(4-fluorophenoxy)phenyl)propanamide
반응식
[NH2:1][C@@H:2]([CH2:20][O:21][CH2:22][C:23]1[CH:28]=[CH:27][CH:26]=[CH:25][CH:24]=1)[C:3]([NH:5][C:6]1[CH:11]=[CH:10][C:9]([O:12][C:13]2[CH:18]=[CH:17][C:16]([F:19])=[CH:15][CH:14]=2)=[CH:8][CH:7]=1)=[O:4].Cl.[CH3:30][C:31]1[C:35]([NH:36][C:37](=O)[OH:38])=[C:34]([CH3:40])[O:33][N:32]=1>>[CH3:30][C:31]1[C:35]([NH:36][C:37](=[O:38])[NH:1][C@@H:2]([CH2:20][O:21][CH2:22][C:23]2[CH:24]=[CH:25][CH:26]=[CH:27][CH:28]=2)[C:3]([NH:5][C:6]2[CH:7]=[CH:8][C:9]([O:12][C:13]3[CH:18]=[CH:17][C:16]([F:19])=[CH:15][CH:14]=3)=[CH:10][CH:11]=2)=[O:4])=[C:34]([CH3:40])[O:33][N:32]=1참가 물질
3
실험 절차
Proceeding as in Example 1, but substituting (S)-2-amino-3-(benzyloxy)-N-(4-(4-fluorophenoxy)phenyl)propanamide and 3,5-dimethylisoxazol-4-ylcarbamic acid hydrochloride, gave Compound 172, (S)-2-(3-(3,5-dimethylisoxazol-4-yl)ureido)-3-benzyloxy-N-(4-(4-fluorophenoxy)phenyl)propanamide. Major isomer: 1H-NMR (400 MHz, DMSO-D6): σ 11.99 (br s, 1H), 9.62 (br s, 1H), 8.40-8.38 (d, 1H), 7.55 (s, 1H), 7.36-7.19 (m, 8H), 7.07-7.02 (m, 2H), 6.94-6.76 (m, 3H), 4.74-4.69 (m, 1H), 4.53 (s, 2H), 3.77-3.64 (m, 2H), 3.53-3.42 (m, 2H), 2.06 (s, 3H). MS (EI) for C28H27FN4O4. found 503.0 (MH+).
출처 및 근거
- ORD 기록
- ord-70415716c22d43a2ac81990b4f3ab805
- 출처 데이터셋
- uspto-grants-2014_07
- 특허 번호
- US08791102B2
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