HCID 67329712, 화합물 → 1-[4-(3-amino-1H-pyrazolo[3,4-b]pyrid-4-yl)phenyl]-3-(2-ethoxy-5-trifluoromethylphenyl)urea

반응식

[CH2:1]([CH3:2])[O:3][c:4]1[c:5]([NH:14][C:15](=[O:16])[NH:17][c:18]2[cH:19][cH:20][c:21]([B:24]3[O:25][C:26]([CH3:27])([CH3:28])[C:29]([CH3:30])([CH3:31])[O:32]3)[cH:22][cH:23]2)[cH:6][c:7]([C:10]([F:11])([F:12])[F:13])[cH:8][cH:9]1.[I:33][c:34]1[c:35]2[c:36]([n:37][cH:38][cH:39]1)[nH:40][n:41][c:42]2[NH2:43]>>[CH2:1]([CH3:2])[O:3][c:4]1[c:5]([NH:14][C:15](=[O:16])[NH:17][c:18]2[cH:19][cH:20][c:21](-[c:34]3[c:35]4[c:36]([n:37][cH:38][cH:39]3)[nH:40][n:41][c:42]4[NH2:43])[cH:22][cH:23]2)[cH:6][c:7]([C:10]([F:11])([F:12])[F:13])[cH:8][cH:9]1

참가 물질

반응물 2

HCID 67329712HCID 67329712, 화합물

HCID 1785092294-Iodo-1H-pyrazolo[3,4-b]pyridin-3-amine

생성물 1

HCID 1784665601-[4-(3-amino-1H-pyrazolo[3,4-b]pyrid-4-yl)phenyl]-3-(2-ethoxy-5-trifluoromethylphenyl)urea

출처 및 근거

ORD 기록: ord-759da0c2fec94e34a3730fdd30fb6a49
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

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