Water → 4-tert-Butyl-N-(3-{5-[4-(4-hydroxy-piperidine-1-carbonyl)-phenylamino]-1-methyl-6-oxo-1,6-dihydro-pyridin-3-yl}-2-methyl-phenyl)-benzamide

HRID 284151Notes

Reaction equation

HRID 284151 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([C:9](=[O:10])[NH:11][c:12]2[c:13]([CH3:36])[c:14](-[c:18]3[cH:19][c:20]([NH:26][c:27]4[cH:28][cH:29][c:30]([C:31](=[O:32])[OH:33])[cH:34][cH:35]4)[c:21](=[O:25])[n:22]([CH3:24])[cH:23]3)[cH:15][cH:16][cH:17]2)[cH:37][cH:38]1.[CH3:66][N:67]([CH3:68])[CH:69]=[O:70].[OH2:78].[OH:71][CH:72]1[CH2:73][CH2:74][NH:75][CH2:76][CH2:77]1.[P-:39]([F:40])([F:41])([F:42])([F:43])([F:44])[F:45].[n:46]1([O:47][P+:48]([N:49]([CH3:50])[CH3:51])([N:52]([CH3:53])[CH3:54])[N:55]([CH3:56])[CH3:57])[c:58]2[cH:59][cH:60][cH:61][cH:62][c:63]2[n:64][n:65]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([C:9](=[O:10])[NH:11][c:12]2[c:13]([CH3:36])[c:14](-[c:18]3[cH:19][c:20]([NH:26][c:27]4[cH:28][cH:29][c:30]([C:31](=[O:32])[N:75]5[CH2:74][CH2:73][CH:72]([OH:71])[CH2:77][CH2:76]5)[cH:34][cH:35]4)[c:21](=[O:25])[n:22]([CH3:24])[cH:23]3)[cH:15][cH:16][cH:17]2)[cH:37][cH:38]1

Participants

7

Reactant 6

HCID 962WaterHCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 79341Piperidin-4-olHCID 124335Benzotriazol-1-yloxy-tris(dimethylamino)phosphoniumHCID 248572324-{5-[3-(4-tert-Butyl-benzoylamino)-2-methylphenyl]-1-methyl-2-oxo-1,2-dihydropyridin-3-ylamino}-benzoic acid

Product 1

HCID 116857604-tert-Butyl-N-(3-{5-[4-(4-hydroxy-piperidine-1-carbonyl)-phenylamino]-1-methyl-6-oxo-1,6-dihydro-pyridin-3-yl}-2-methyl-phenyl)-benzamide

Sources & evidence

ORD record
ord-6bbbd4a4c1494bb59e5eef5468d0d641
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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