Sodium ion → 3-[4-(1-benzyl-2-methyl-1H-benzimidazol-4-yl)phenyl]-1-{[2-(trimethylsilyl)ethoxy]methyl}-1,3-dihydro-2H-imidazo[4,5-b]pyridin-2-one

HRID 2142354Notes

Reaction equation

HRID 2142354 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[c:9]([CH3:18])[n:10][c:11]2[c:12]1[cH:13][cH:14][cH:15][c:16]2[Br:17].[CH2:58]1[O:59][CH2:60][CH2:61][CH2:62]1.[CH3:19][C:20]1([CH3:21])[C:22]([CH3:23])([CH3:24])[O:25][B:26]([c:27]2[cH:28][cH:29][c:30](-[n:33]3[c:34](=[O:50])[n:35]([CH2:42][O:43][CH2:44][CH2:45][Si:46]([CH3:47])([CH3:48])[CH3:49])[c:36]4[c:37]3[n:38][cH:39][cH:40][cH:41]4)[cH:31][cH:32]2)[O:51]1.[Na+:52].[Na+:53].[O-:54][C:55](=[O:56])[O-:57].[OH2:140].[cH:63]1[cH:64][cH:65][c:66]([P:67]([Pd:68]([P:69]([c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)([c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)[c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)([P:88]([c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)([c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)[c:101]2[cH:102][cH:103][cH:104][cH:105][cH:106]2)[P:107]([c:108]2[cH:109][cH:110][cH:111][cH:112][cH:113]2)([c:114]2[cH:115][cH:116][cH:117][cH:118][cH:119]2)[c:120]2[cH:121][cH:122][cH:123][cH:124][cH:125]2)([c:126]2[cH:127][cH:128][cH:129][cH:130][cH:131]2)[c:132]2[cH:133][cH:134][cH:135][cH:136][cH:137]2)[cH:138][cH:139]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[c:9]([CH3:18])[n:10][c:11]2[c:12]1[cH:13][cH:14][cH:15][c:16]2-[c:27]1[cH:28][cH:29][c:30](-[n:33]2[c:34](=[O:50])[n:35]([CH2:42][O:43][CH2:44][CH2:45][Si:46]([CH3:47])([CH3:48])[CH3:49])[c:36]3[c:37]2[n:38][cH:39][cH:40][cH:41]3)[cH:31][cH:32]1

Participants

8

Reactant 7

HCID 923Sodium ion2×HCID 962WaterHCID 8028TetrahydrofuranHCID 19660Carbonate IonHCID 585773473-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1-{[2-(trimethylsilyl)ethoxy]methyl}-1,3-dihydro-2H-imidazo[4,5-b]pyridin-2-oneHCID 671269161-benzyl-4-bromo-2-methyl-1H-benzo[d]imidazoleHCID 178420554HCID 178420554, compound

Product 1

HCID 585773783-[4-(1-benzyl-2-methyl-1H-benzimidazol-4-yl)phenyl]-1-{[2-(trimethylsilyl)ethoxy]methyl}-1,3-dihydro-2H-imidazo[4,5-b]pyridin-2-one

Sources & evidence

ORD record
ord-ee6c7bfd016449eabb62df962e3e6489
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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