Nipecotic Acid → 1-(4-{5-[1-(2-fluorophenyl)-5-pyridin-4-yl-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazol-3-yl}benzyl)piperidine-3-carboxylic acid

HRID 2329679

Reaction equation

HRID 2329679 reaction equation
[F:1][c:2]1[c:3](-[n:8]2[n:9][n:10][c:11](-[c:19]3[n:20][c:21](-[c:24]4[cH:25][cH:26][c:27]([CH:28]=[O:29])[cH:30][cH:31]4)[n:22][o:23]3)[c:12]2-[c:13]2[cH:14][cH:15][n:16][cH:17][cH:18]2)[cH:4][cH:5][cH:6][cH:7]1.[OH:32][C:33](=[O:34])[CH:35]1[CH2:36][CH2:37][CH2:38][NH:39][CH2:40]1>>[F:1][c:2]1[c:3](-[n:8]2[n:9][n:10][c:11](-[c:19]3[n:20][c:21](-[c:24]4[cH:25][cH:26][c:27]([CH2:28][N:39]5[CH2:38][CH2:37][CH2:36][CH:35]([C:33]([OH:32])=[O:34])[CH2:40]5)[cH:30][cH:31]4)[n:22][o:23]3)[c:12]2-[c:13]2[cH:14][cH:15][n:16][cH:17][cH:18]2)[cH:4][cH:5][cH:6][cH:7]1

Participants

3

Reactant 2

HCID 4498Nipecotic AcidHCID 866481594-(5-(1-(2-fluorophenyl)-5-(pyridin-4-yl)-1H-1,2,3-triazol-4-yl)-1,2,4-oxadiazol-3-yl) benzaldehyde

Product 1

HCID 596040611-(4-{5-[1-(2-fluorophenyl)-5-pyridin-4-yl-1H-1,2,3-triazol-4-yl]-1,2,4-oxadiazol-3-yl}benzyl)piperidine-3-carboxylic acid

Sources & evidence

ORD record
ord-7b31d472f3b34178a21ce865321bae0d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Linked notes

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