Hydrochloric Acid → Hydrochloric Acid

반응식

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

참가 물질

반응물 3

HCID 313Hydrochloric Acid

HCID 312751,4-Dioxane

HCID 579648894-[4-(2,4,5-Trifluoro-phenoxy)-pyrazolo[3,4-d]pyrimidin-1-yl]-piperidine-1-carboxylic acid tert-butyl ester

생성물 2

HCID 313Hydrochloric Acid

HCID 669154551-Piperidin-4-yl-4-(2,4,5-trifluorophenoxy)pyrazolo[5,4-d]pyrimidine

출처 및 근거

ORD 기록: ord-2779901d514c4a399653ce1249f59ca1
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

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