1-[4-[4-[6-Amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]pyrazol-1-yl]piperidin-1-yl]-2-hydroxyethanone → 3-(1-(2,6-Dichloro-3-fluorophenyl)ethoxy)-5-(1-(piperidin-4-yl)-1H-pyrazol-4-yl)pyridin-2-amine
반응식
[Cl:1][c:2]1[c:3]([F:4])[cH:5][cH:6][c:7]([Cl:8])[c:9]1[CH:10]([O:11][c:12]1[c:13]([NH2:14])[n:15][cH:16][c:17]([B:18]2[O:19][C:20]([CH3:21])([CH3:22])[C:23]([CH3:24])([CH3:25])[O:26]2)[cH:27]1)[CH3:28].[NH2:29][c:30]1[c:31]([O:51][CH:52]([CH3:53])[c:54]2[c:55]([Cl:62])[c:56]([F:61])[cH:57][cH:58][c:59]2[Cl:60])[cH:32][c:33](-[c:36]2[cH:37][n:38][n:39]([CH:41]3[CH2:42][CH2:43][N:44]([C:47](=[O:48])[CH2:49][OH:50])[CH2:45][CH2:46]3)[cH:40]2)[cH:34][n:35]1>>[NH2:29][c:30]1[c:31]([O:51][CH:52]([CH3:53])[c:54]2[c:55]([Cl:62])[c:56]([F:61])[cH:57][cH:58][c:59]2[Cl:60])[cH:32][c:33](-[c:36]2[cH:37][n:38][n:39]([CH:41]3[CH2:42][CH2:43][NH:44][CH2:45][CH2:46]3)[cH:40]2)[cH:34][n:35]1참가 물질
3
반응물 2
생성물 1
출처 및 근거
- ORD 기록
- ord-e089648dee7247428456144c18b33ae3
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)