2-methyl-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]propan-2-ol → 1-(4-(2-(3-(hydroxymethyl)-1-isopropyl-1H-1,2,4-triazol-5-yl)-5,6-dihydrobenzo[f]imidazo[1,2-d][1,4]oxazepin-9-yl)-1H-pyrazol-1-yl)-2-methylpropan-2-ol

HRID 2326060Notes

Reaction equation

HRID 2326060 reaction equation
[Br:1][c:2]1[cH:3][c:4]2[c:5]([cH:24][cH:25]1)-[c:6]1[n:7]([cH:11][c:12](-[c:14]3[n:15][c:16]([CH2:22][OH:23])[n:17][n:18]3[CH:19]([CH3:20])[CH3:21])[n:13]1)[CH2:8][CH2:9][O:10]2.[CH3:26][C:27]([CH2:28][n:29]1[n:30][cH:31][c:32]([B:34]2[O:35][C:36]([CH3:37])([CH3:38])[C:39]([CH3:40])([CH3:41])[O:42]2)[cH:33]1)([CH3:43])[OH:44]>>[c:2]1(-[c:32]2[cH:31][n:30][n:29]([CH2:28][C:27]([CH3:26])([CH3:43])[OH:44])[cH:33]2)[cH:3][c:4]2[c:5]([cH:24][cH:25]1)-[c:6]1[n:7]([cH:11][c:12](-[c:14]3[n:15][c:16]([CH2:22][OH:23])[n:17][n:18]3[CH:19]([CH3:20])[CH3:21])[n:13]1)[CH2:8][CH2:9][O:10]2

Participants

3

Reactant 2

HCID 582041312-methyl-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]propan-2-olHCID 58204744(5-(9-bromo-5,6-dihydrobenzo[f]imidazo[1,2-d][1,4]oxazepin-2-yl)-1-isopropyl-1H-1,2,4-triazol-3-yl)methanol

Product 1

HCID 582045131-(4-(2-(3-(hydroxymethyl)-1-isopropyl-1H-1,2,4-triazol-5-yl)-5,6-dihydrobenzo[f]imidazo[1,2-d][1,4]oxazepin-9-yl)-1H-pyrazol-1-yl)-2-methylpropan-2-ol

Sources & evidence

ORD record
ord-8002a12db66742abb794c8b1546aee06
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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