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Hydrochloric Acid → Isopropyl 4,6-diamino-2-[1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]-5-pyrimidinylcarbamate

HRID 1548937
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HRID 1548937 반응식
[CH3:43][OH:44].[Cl:36][C:37](=[O:38])[O:39][CH:40]([CH3:41])[CH3:42].[Cl:45][CH2:46][Cl:47].[ClH:1].[ClH:2].[ClH:3].[F:4][c:5]1[c:6]([CH2:7][n:8]2[n:9][c:10](-[c:17]3[n:18][c:19]([NH2:25])[c:20]([NH2:24])[c:21]([NH2:23])[n:22]3)[c:11]3[c:12]2[n:13][cH:14][cH:15][cH:16]3)[cH:26][cH:27][cH:28][cH:29]1.[cH:30]1[cH:31][cH:32][n:33][cH:34][cH:35]1>>[F:4][c:5]1[c:6]([CH2:7][n:8]2[n:9][c:10](-[c:17]3[n:18][c:19]([NH2:25])[c:20]([NH:24][C:37](=[O:38])[O:39][CH:40]([CH3:41])[CH3:42])[c:21]([NH2:23])[n:22]3)[c:11]3[c:12]2[n:13][cH:14][cH:15][cH:16]3)[cH:26][cH:27][cH:28][cH:29]1
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반응물 6

HCID 313Hydrochloric Acid3회HCID 887MethanolHCID 1049PyridineHCID 6344DichloromethaneHCID 7917Isopropyl chloroformateHCID 113939732-(1-((2-Fluorophenyl)methyl)-1H-pyrazolo(3,4-b)pyridin-3-yl)-4,5,6-pyrimidinetriamine

생성물 1

HCID 17973417
Isopropyl 4,6-diamino-2-[1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]-5-pyrimidinylcarbamate

출처 및 근거

ORD 기록
ord-2d8c2f918f1d428aba28e9177ecd2299
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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