Ammonium → 1,1-dimethylethyl 4-[2-(4-amino-5-bromo-7H-pyrrolo[2,3-d]pyrimidin-7-yl)ethyl]-1-piperidinecarboxylate

반응식

[Br:1][c:2]1[cH:3][n:4]([CH2:12][CH2:13][CH:14]2[CH2:15][CH2:16][N:17]([C:20](=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26])[CH2:18][CH2:19]2)[c:5]2[n:6][cH:7][n:8][c:9]([Cl:11])[c:10]12.[NH4+:27].[OH-:28]>>[Br:1][c:2]1[cH:3][n:4]([CH2:12][CH2:13][CH:14]2[CH2:15][CH2:16][N:17]([C:20](=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26])[CH2:18][CH2:19]2)[c:5]2[n:6][cH:7][n:8][c:9]([NH2:27])[c:10]12

참가 물질

반응물 3

HCID 223Ammonium

HCID 961Hydroxide

HCID 866636851,1-dimethylethyl 4-[2-(5-bromo-4-chloro-7H-pyrrolo[2,3-d]pyrimidin-7-yl)ethyl]-1-piperidinecarboxylate

생성물 1

HCID 668239481,1-dimethylethyl 4-[2-(4-amino-5-bromo-7H-pyrrolo[2,3-d]pyrimidin-7-yl)ethyl]-1-piperidinecarboxylate

출처 및 근거

ORD 기록: ord-e303a563cd104f61acff7be60deaffc3
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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