Sodium ion → HCID 24880024, compound

HRID 1138330Notes

Reaction equation

HRID 1138330 reaction equation
[Br:1][c:2]1[cH:3][c:4]2[n:5][cH:6][n:7][c:8]([NH:11][CH2:12][CH2:13][c:14]3[cH:15][n:16][c:17]([NH:19][C:20](=[O:21])[NH:22][c:23]4[cH:24][c:25]([C:29]([F:30])([F:31])[F:32])[cH:26][cH:27][cH:28]4)[s:18]3)[c:9]2[s:10]1.[C:33]([O:34][C:35]([N:36]1[CH2:37][CH:38]=[C:39]([B:40]2[O:41][C:42]([CH3:43])([CH3:44])[C:45]([CH3:46])([CH3:47])[O:48]2)[CH2:49][CH2:50]1)=[O:51])([CH3:52])([CH3:53])[CH3:54].[C:55](=[O:56])([O-:57])[O-:58].[Na+:59].[Na+:60].[O:102]=[CH:103][N:104]([CH3:105])[CH3:106].[OH2:107].[Pd:61]([Cl:62])[Cl:63].[c:64]1([P:65]([c:66]2[cH:67][cH:68][cH:69][cH:70][cH:71]2)[c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)[cH:78][cH:79][cH:80][cH:81][cH:82]1.[c:83]1([P:84]([c:85]2[cH:86][cH:87][cH:88][cH:89][cH:90]2)[c:91]2[cH:92][cH:93][cH:94][cH:95][cH:96]2)[cH:97][cH:98][cH:99][cH:100][cH:101]1>>[cH:2]1[cH:3][c:4]2[n:5][cH:6][n:7][c:8]([NH:11][CH2:12][CH2:13][c:14]3[cH:15][n:16][c:17]([NH:19][C:20](=[O:21])[NH:22][c:23]4[cH:24][c:25]([C:29]([F:30])([F:31])[F:32])[cH:26][cH:27][cH:28]4)[s:18]3)[c:9]2[s:10]1

Participants

9

Reactant 8

HCID 923Sodium ion2×HCID 962WaterHCID 6228DimethylformamideHCID 11776Triphenylphosphine2×HCID 19660Carbonate IonHCID 24290Palladium ChlorideHCID 4642098Tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2,3,6-tetrahydropyridine-1-carboxylateHCID 86603176HCID 86603176, compound

Product 1

HCID 24880024HCID 24880024, compound

Sources & evidence

ORD record
ord-c28c5d7f6d2c4403bdb5eb84807a66c7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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