6-[4-[2-(Difluoromethyl)-3-fluorobenzyl]piperazin-1-yl]-3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazine → 3-(Difluoromethyl)-6-[4-[2-(difluoromethyl)-3-fluorobenzyl]piperazin-1-yl][1,2,4]triazolo[4,3-b]pyridazine
반응식
[F:19][CH:20]([c:21]1[c:22]([CH2:23][N:24]2[CH2:25][CH2:26][N:27]([c:30]3[cH:31][cH:32][c:33]4[n:34]([n:35]3)[c:36]([C:39]([F:40])([F:41])[F:42])[n:37][n:38]4)[CH2:28][CH2:29]2)[cH:43][cH:44][cH:45][c:46]1[F:47])[F:48].[F:1][CH:2]([F:3])[c:4]1[n:5]2[n:6][c:7]([N:8]3[CH2:9][CH2:10][NH:11][CH2:12][CH2:13]3)[cH:14][cH:15][c:16]2[n:17][n:18]1>>[F:19][CH:20]([c:21]1[c:22]([CH2:23][N:24]2[CH2:25][CH2:26][N:27]([c:30]3[cH:31][cH:32][c:33]4[n:34]([n:35]3)[c:36]([CH:39]([F:40])[F:41])[n:37][n:38]4)[CH2:28][CH2:29]2)[cH:43][cH:44][cH:45][c:46]1[F:47])[F:48]참가 물질
3
반응물 2
생성물 1
출처 및 근거
- ORD 기록
- ord-de90df54f37b4ddda84a6bc7d352766b
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
반응 노트
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