4-Bromopyridine → HCID 178452677, compound

HRID 1571517Notes

Reaction equation

HRID 1571517 reaction equation
[Br:1][c:2]1[cH:3][cH:4][n:5][cH:6][cH:7]1.[C:74](=[O:75])([O-:76])[O-:77].[Cs+:78].[Cs+:79].[F:8][c:9]1[c:10]([CH:16]2[CH2:17][CH2:18][CH:19]([NH:24][C:25]([O:26][C:27]([CH3:28])([CH3:29])[CH3:30])=[O:31])[C:20](=[O:23])[NH:21][CH2:22]2)[cH:11][cH:12][cH:13][c:14]1[F:15].[O:106]=[C:107]([CH:108]=[CH:109][c:110]1[cH:111][cH:112][cH:113][cH:114][cH:115]1)[CH:116]=[CH:117][c:118]1[cH:119][cH:120][cH:121][cH:122][cH:123]1.[O:124]=[C:125]([CH:126]=[CH:127][c:128]1[cH:129][cH:130][cH:131][cH:132][cH:133]1)[CH:134]=[CH:135][c:136]1[cH:137][cH:138][cH:139][cH:140][cH:141]1.[O:80]1[CH2:81][CH2:82][O:83][CH2:84][CH2:85]1.[O:88]=[C:89]([CH:90]=[CH:91][c:92]1[cH:93][cH:94][cH:95][cH:96][cH:97]1)[CH:98]=[CH:99][c:100]1[cH:101][cH:102][cH:103][cH:104][cH:105]1.[Pd:86].[Pd:87].[c:32]1([P:33]([c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[c:40]2[c:41]3[c:65]([cH:66][cH:67][cH:68]2)[C:62]([CH3:63])([CH3:64])[c:44]2[c:43]([c:48]([P:49]([c:50]4[cH:51][cH:52][cH:53][cH:54][cH:55]4)[c:56]4[cH:57][cH:58][cH:59][cH:60][cH:61]4)[cH:47][cH:46][cH:45]2)[O:42]3)[cH:69][cH:70][cH:71][cH:72][cH:73]1>>[c:2]1([N:21]2[C:20](=[O:23])[CH:19]([NH:24][C:25]([O:26][C:27]([CH3:28])([CH3:29])[CH3:30])=[O:31])[CH2:18][CH2:17][CH:16]([c:10]3[c:9]([F:8])[c:14]([F:15])[cH:13][cH:12][cH:11]3)[CH2:22]2)[cH:3][cH:4][n:5][cH:6][cH:7]1

Participants

9

Reactant 8

HCID 142684-BromopyridineHCID 19660Carbonate IonHCID 23938Palladium2×HCID 312751,4-DioxaneHCID 95417Dibenzylidene acetone3×HCID 104967Cesium cation2×HCID 6360441,1'-(9,9-Dimethyl-9H-xanthene-4,5-diyl)bis(1,1-diphenylphosphine)HCID 74081309tert-butyl N-[6-(2,3-difluorophenyl)-2-oxoazepan-3-yl]carbamate

Product 1

HCID 178452677HCID 178452677, compound

Sources & evidence

ORD record
ord-2abade4f3e274db886474fc75b81c106
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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