Water → (1-{1-[5-(4-Fluoro-phenyl)-2-methyl-thiazol-4-yl]-methanoyl}-piperidin-2-yl)-acetic acid methyl ester

HRID 2341272Notes

Reaction equation

HRID 2341272 reaction equation
[CH3:50][O:51][C:52]([CH2:53][CH:54]1[NH:55][CH2:56][CH2:57][CH2:58][CH2:59]1)=[O:60].[CH:17]([N:18]([CH2:19][CH3:20])[CH:21]([CH3:22])[CH3:23])([CH3:24])[CH3:25].[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9]([C:14](=[O:15])[OH:16])[n:10][c:11]([CH3:13])[s:12]2)[cH:6][cH:7]1.[O:61]=[CH:62][N:63]([CH3:64])[CH3:65].[OH2:66].[P-:26]([F:27])([F:28])([F:29])([F:30])([F:31])[F:32].[n:33]1([O:34][C:35]([N:36]([CH3:37])[CH3:38])=[N+:39]([CH3:40])[CH3:41])[c:42]2[n:43][cH:44][cH:45][cH:46][c:47]2[n:48][n:49]1>>[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9]([C:14](=[O:16])[N:55]3[CH:54]([CH2:53][C:52]([O:51][CH3:50])=[O:60])[CH2:59][CH2:58][CH2:57][CH2:56]3)[n:10][c:11]([CH3:13])[s:12]2)[cH:6][cH:7]1

Participants

8

Reactant 7

HCID 962WaterHCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 5214606Methyl piperidin-2-ylacetateHCID 223241255-(4-Fluorophenyl)-2-methyl-1,3-thiazole-4-carboxylic acid

Product 1

HCID 66968203(1-{1-[5-(4-Fluoro-phenyl)-2-methyl-thiazol-4-yl]-methanoyl}-piperidin-2-yl)-acetic acid methyl ester

Sources & evidence

ORD record
ord-bae127d74971498ba44f0c7a255ed612
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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