Bicarbonate Ion → Methyl (6-{4-[({5-[(2-fluorophenyl)amino]-1,3,4-oxadiazol-2-yl}carbonyl)amino]piperidin-1-yl}-1-oxidopyridin-3-yl)acetate

HRID 1141559Notes

Reaction equation

HRID 1141559 reaction equation
[C:36](=[O:37])([O-:38])[OH:39].[CH3:41][C:42]([OH:43])([CH2:44][CH3:45])[CH3:46].[Cl:23][c:24]1[cH:25][cH:26][c:27]([CH2:31][C:32](=[O:33])[O:34][CH3:35])[cH:28][n+:29]1[O-:30].[F:1][c:2]1[c:3]([NH:8][c:9]2[n:10][n:11][c:12]([C:14](=[O:15])[NH:16][CH:17]3[CH2:18][CH2:19][NH:20][CH2:21][CH2:22]3)[o:13]2)[cH:4][cH:5][cH:6][cH:7]1.[Na+:40]>>[F:1][c:2]1[c:3]([NH:8][c:9]2[n:10][n:11][c:12]([C:14](=[O:15])[NH:16][CH:17]3[CH2:18][CH2:19][N:20]([c:24]4[cH:25][cH:26][c:27]([CH2:31][C:32](=[O:33])[O:34][CH3:35])[cH:28][n+:29]4[O-:30])[CH2:21][CH2:22]3)[o:13]2)[cH:4][cH:5][cH:6][cH:7]1

Participants

6

Reactant 5

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 64052-Methyl-2-butanolHCID 59464117HCID 59464117, compoundHCID 594641305-[(2-fluorophenyl)amino]-N-piperidin-4-yl-1,3,4-oxadiazole-2-carboxamide

Product 1

HCID 59619585Methyl (6-{4-[({5-[(2-fluorophenyl)amino]-1,3,4-oxadiazol-2-yl}carbonyl)amino]piperidin-1-yl}-1-oxidopyridin-3-yl)acetate

Sources & evidence

ORD record
ord-be9d68ea478c457a880d623ded7294b7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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