Hydrochloric Acid → 6-(5-benzylhexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl)-3-[chloro(difluoro)methyl][1,2,4]triazolo[4,3-b]pyridazine

반응식

[CH2:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[N:9]1[CH2:10][CH:11]2[CH2:12][NH:13][CH2:14][CH:15]2[CH2:16]1.[Cl:17][c:18]1[cH:19][cH:20][c:21]2[n:22]([n:23]1)[c:24]([C:27]([F:28])([F:29])[Cl:30])[n:25][n:26]2.[ClH:1]>>[CH2:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[N:9]1[CH2:10][CH:11]2[CH2:12][N:13]([c:18]3[cH:19][cH:20][c:21]4[n:22]([n:23]3)[c:24]([C:27]([F:28])([F:29])[Cl:30])[n:25][n:26]4)[CH2:14][CH:15]2[CH2:16]1

참가 물질

반응물 3

HCID 313Hydrochloric Acid

HCID 14891146-Chloro-3-[chloro(difluoro)methyl][1,2,4]triazolo[4,3-b]pyridazine

HCID 44543872-Benzyloctahydropyrrolo[3,4-c]pyrrole

생성물 1

HCID 591496996-(5-benzylhexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl)-3-[chloro(difluoro)methyl][1,2,4]triazolo[4,3-b]pyridazine

출처 및 근거

ORD 기록: ord-e659c868e2e447fcbcd1f2f25d8a3040
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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