1-Benzyl-1,4-diazepane → 6-(4-Benzyl-1,4-diazepan-1-yl)-3-(difluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazine

HRID 175761

반응식

HRID 175761 반응식
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH2:10][NH:11][CH2:12][CH2:13][CH2:14]1.[Cl:15][c:16]1[cH:17][cH:18][c:19]2[n:20]([n:21]1)[c:22]([CH:25]([F:26])[F:27])[n:23][n:24]2>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH2:10][N:11]([c:16]2[cH:17][cH:18][c:19]3[n:20]([n:21]2)[c:22]([CH:25]([F:26])[F:27])[n:23][n:24]3)[CH2:12][CH2:13][CH2:14]1

참가 물질

3

반응물 2

HCID 2283651-Benzyl-1,4-diazepaneHCID 14723856-Chloro-3-(difluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazine

생성물 1

HCID 673427926-(4-Benzyl-1,4-diazepan-1-yl)-3-(difluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazine

출처 및 근거

ORD 기록
ord-0cd7f86c6a5c409d804c6891ef86660c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

연결된 노트

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