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Boronic Acid → tert-Butyl {4-[5-(2,6-dimethyl-pyridin-4-yl)-2-methoxy-benzylamino]-cyclohexyl}-methyl-carbamate

HRID 2310416
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HRID 2310416 반응식
[BH:1]([OH:2])[OH:3].[C:4](=[O:5])([O:6][C:7]([CH3:8])([CH3:9])[CH3:10])[N:11]([CH:12]1[CH2:13][CH2:14][CH:15]([NH:18][CH2:19][c:20]2[cH:21][cH:22][cH:23][cH:24][c:25]2[O:26][CH3:27])[CH2:16][CH2:17]1)[CH3:28].[F:29][C:30]([F:31])([F:32])[S:33]([O:34][c:35]1[cH:36][c:37]([CH3:42])[n:38][c:39]([CH3:41])[cH:40]1)(=[O:43])=[O:44]>>[C:4](=[O:5])([O:6][C:7]([CH3:8])([CH3:9])[CH3:10])[N:11]([CH:12]1[CH2:13][CH2:14][CH:15]([NH:18][CH2:19][c:20]2[cH:21][c:22](-[c:35]3[cH:36][c:37]([CH3:42])[n:38][c:39]([CH3:41])[cH:40]3)[cH:23][cH:24][c:25]2[O:26][CH3:27])[CH2:16][CH2:17]1)[CH3:28]
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반응물 3

HCID 61668Boronic AcidHCID 216236792,6-Dimethyl-pyridin-4-yl trifluoromethanesulfonateHCID 69166809tert-butyl N-[4-[(2-methoxyphenyl)methylamino]cyclohexyl]-N-methylcarbamate

생성물 1

HCID 59683595tert-Butyl {4-[5-(2,6-dimethyl-pyridin-4-yl)-2-methoxy-benzylamino]-cyclohexyl}-methyl-carbamate

출처 및 근거

ORD 기록
ord-c080cf6eb890400f98dba659300918f0
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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