Triphenylphosphine → (6R)-6-(2-Hydroxy-2-methylpropyl)-3-[(1R)-1-[4-(1-methyl-2-oxopyridin-4-yl)phenyl]ethyl]-6-phenyl-1,3-oxazinan-2-one

HRID 1124624Notes

Reaction equation

HRID 1124624 reaction equation
[C:45](=[O:46])([O-:47])[O-:48].[CH2:51]1[O:52][CH2:53][CH2:54][O:55][CH2:56]1.[Cs+:49].[Cs+:50].[I:1][c:2]1[cH:3][c:4](=[O:9])[n:5]([CH3:8])[cH:6][cH:7]1.[OH:10][C:11]([CH2:12][C:13]1([c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[CH2:14][CH2:15][N:16]([CH:20]([CH3:21])[c:22]2[cH:23][cH:24][c:25]([B:28]3[O:29][C:30]([CH3:31])([CH3:32])[C:33]([CH3:34])([CH3:35])[O:36]3)[cH:26][cH:27]2)[C:17](=[O:19])[O:18]1)([CH3:43])[CH3:44].[Pd:57]([Cl:58])[Cl:59].[c:60]1([P:61]([c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)[c:68]2[cH:69][cH:70][cH:71][cH:72][cH:73]2)[cH:74][cH:75][cH:76][cH:77][cH:78]1.[c:79]1([P:80]([c:81]2[cH:82][cH:83][cH:84][cH:85][cH:86]2)[c:87]2[cH:88][cH:89][cH:90][cH:91][cH:92]2)[cH:93][cH:94][cH:95][cH:96][cH:97]1>>[c:2]1(-[c:25]2[cH:24][cH:23][c:22]([CH:20]([N:16]3[CH2:15][CH2:14][C:13]([CH2:12][C:11]([OH:10])([CH3:43])[CH3:44])([c:37]4[cH:38][cH:39][cH:40][cH:41][cH:42]4)[O:18][C:17]3=[O:19])[CH3:21])[cH:27][cH:26]2)[cH:3][c:4](=[O:9])[n:5]([CH3:8])[cH:6][cH:7]1

Participants

8

Reactant 7

HCID 11776Triphenylphosphine2×HCID 19660Carbonate IonHCID 24290Palladium ChlorideHCID 312751,4-DioxaneHCID 104967Cesium cation2×HCID 534080094-Iodo-1-methylpyridin-2(1H)-oneHCID 670197526-(2-Hydroxy-2-methylpropyl)-6-phenyl-3-[1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethyl]-1,3-oxazinan-2-one

Product 1

HCID 75032458(6R)-6-(2-Hydroxy-2-methylpropyl)-3-[(1R)-1-[4-(1-methyl-2-oxopyridin-4-yl)phenyl]ethyl]-6-phenyl-1,3-oxazinan-2-one

Sources & evidence

ORD record
ord-192a8baad6c047288cbe74d09d985e8c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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