m-Tolyl isocyanate → HCID 11588815, 화합물

HRID 1159452노트

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HRID 1159452 반응식
[NH2:1][C:2]1[CH:7]=[CH:6][C:5]([C:8]2[CH:13]=[N:12][CH:11]=[C:10]3[N:14]([CH3:18])[N:15]=[C:16]([NH2:17])[C:9]=23)=[CH:4][CH:3]=1.[N:19]([C:22]1[CH:27]=[CH:26][CH:25]=[C:24]([CH3:28])[CH:23]=1)=[C:20]=[O:21].FC1C=CC(C)=CC=1N=C=O>>[NH2:17][C:16]1[C:9]2[C:10](=[CH:11][N:12]=[CH:13][C:8]=2[C:5]2[CH:4]=[CH:3][C:2]([NH:1][C:20]([NH:19][C:22]3[CH:27]=[CH:26][CH:25]=[C:24]([CH3:28])[CH:23]=3)=[O:21])=[CH:7][CH:6]=2)[N:14]([CH3:18])[N:15]=1

참가 물질

4

반응물 3

HCID 69303m-Tolyl isocyanateHCID 27333772-Fluoro-5-methylphenyl isocyanateHCID 686444744-(4-Amino-phenyl)-1-methyl-1H-pyrazolo[3,4-c]pyridin-3-ylamine

생성물 1

HCID 11588815HCID 11588815, 화합물

실험 절차

The title compound was prepared using the procedure described in Example 1E using the product from Example 6A and 1-isocyanato-3-methyl-benzene instead of the product from Example 1D and 1-fluoro-2-isocyanato-4-methyl-benzene. MS (ESI(+)) m/e 373 (M+H)+; 1H NMR (300 MHz, DMSO-D6) δ ppm 2.29 (s, 3H) 4.02 (s, 3H) 6.81 (d, J=7.12 Hz, 1H) 7.17 (t, J=7.80 Hz, 1H) 7.26 (d, J=8.14 Hz, 1H) 7.32 (s, 1H) 7.52 (d, J=8.82 Hz, 2H) 7.68 (d, J=8.82 Hz, 2H) 8.10 (s, 1H) 8.71 (s, 1H) 8.95 (s, 1H) 9.20 (s, 1H).

출처 및 근거

ORD 기록
ord-cc03320690974839b3a56e4fded24f43
출처 데이터셋
uspto-grants-2010_10
특허 번호
US07812166B2

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