Acetate → Benzyl 2-({6-[(2-{4-[(biphenyl-2-ylcarbamoyl)oxy]piperidin-1-yl}ethyl)(methyl)amino]-6-oxohexyl}amino)pyrimidine-5-carboxylate

HRID 318082Notes

Reaction equation

HRID 318082 reaction equation
[C:57]=[O:58].[C:70]([O-:71])(=[O:72])[CH3:73].[C:75]([O-:76])(=[O:77])[CH3:78].[CH3:42][CH2:43][N:44]([CH2:45][CH3:46])[CH2:47][CH3:48].[CH3:59][N:60]([CH:61]=[O:62])[CH3:63].[CH3:64][CH2:65][O:66][C:67](=[O:68])[CH3:69].[OH:49][CH2:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[Pd+2:74].[c:1]1(-[c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[c:2]([NH:7][C:8]([O:9][CH:10]2[CH2:11][CH2:12][N:13]([CH2:16][CH2:17][N:18]([CH3:19])[C:20]([CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][NH:26][c:27]3[n:28][cH:29][c:30]([Br:33])[cH:31][n:32]3)=[O:34])[CH2:14][CH2:15]2)=[O:35])[cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[c:2]([NH:7][C:8]([O:9][CH:10]2[CH2:11][CH2:12][N:13]([CH2:16][CH2:17][N:18]([CH3:19])[C:20]([CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][NH:26][c:27]3[n:28][cH:29][c:30]([C:61]([O:49][CH2:50][c:51]4[cH:52][cH:53][cH:54][cH:55][cH:56]4)=[O:62])[cH:31][n:32]3)=[O:34])[CH2:14][CH2:15]2)=[O:35])[cH:3][cH:4][cH:5][cH:6]1

Participants

9

Reactant 8

HCID 175Acetate2×HCID 244Benzyl AlcoholHCID 712FormaldehydeHCID 6228DimethylformamideHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 666715871-{2-[{6-[(5-Bromopyrimidin-2-yl)amino]hexanoyl}(methyl)amino]ethyl}piperidin-4-yl biphenyl-2-ylcarbamate

Product 1

HCID 66671726Benzyl 2-({6-[(2-{4-[(biphenyl-2-ylcarbamoyl)oxy]piperidin-1-yl}ethyl)(methyl)amino]-6-oxohexyl}amino)pyrimidine-5-carboxylate

Sources & evidence

ORD record
ord-212627be78434c66a9cd47ae97e11ce9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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