p-Toluenesulfonate → 1-(4-(3-(hydroxymethyl)piperidin-1-yl)-2-(4-(oxazol-5-yl)phenylamino)-7,8-dihydropyrido[4,3-d]pyrimidin-6(5H)-yl)ethanone

HRID 116829

Reaction equation

HRID 116829 reaction equation
[F:9][C:10]([F:11])([F:12])[S:13]([O:14][c:15]1[c:16]2[c:17]([n:18][c:19]([NH:21][c:22]3[cH:23][cH:24][c:25](-[c:28]4[cH:29][n:30][cH:31][o:32]4)[cH:26][cH:27]3)[n:20]1)[CH2:33][CH2:34][N:35]([C:37]([CH3:38])=[O:39])[CH2:36]2)(=[O:40])=[O:41].[NH:1]1[CH2:2][CH:3]([CH2:7][OH:8])[CH2:4][CH2:5][CH2:6]1.[O-:42][S:43]([c:44]1[cH:45][cH:46][c:47]([CH3:48])[cH:49][cH:50]1)(=[O:51])=[O:52]>>[N:1]1([c:15]2[c:16]3[c:17]([n:18][c:19]([NH:21][c:22]4[cH:23][cH:24][c:25](-[c:28]5[cH:29][n:30][cH:31][o:32]5)[cH:26][cH:27]4)[n:20]2)[CH2:33][CH2:34][N:35]([C:37]([CH3:38])=[O:39])[CH2:36]3)[CH2:2][CH:3]([CH2:7][OH:8])[CH2:4][CH2:5][CH2:6]1

Participants

4

Reactant 3

HCID 85570p-ToluenesulfonateHCID 107308Piperidin-3-ylmethanolHCID 593337606-Acetyl-2-(4-(oxazol-5-yl)phenylamino)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-yl trifluoromethanesulfonate

Product 1

HCID 462000561-(4-(3-(hydroxymethyl)piperidin-1-yl)-2-(4-(oxazol-5-yl)phenylamino)-7,8-dihydropyrido[4,3-d]pyrimidin-6(5H)-yl)ethanone

Sources & evidence

ORD record
ord-a9075bf67ae044918b2b11b2325a29ea
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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