Sodium ion → 8-(cyclopropylmethoxy)-4-(3,5-dimethylpyridin-4-ylamino)-7-methoxyquinolin-2(1H)-one

HRID 1113443Notes

Reaction equation

HRID 1113443 reaction equation
[Br:20][c:21]1[c:22]([CH3:28])[cH:23][n:24][cH:25][c:26]1[CH3:27].[CH3:125][c:126]1[cH:127][cH:128][cH:129][cH:130][cH:131]1.[CH3:63][C:64]([CH3:65])([O-:66])[CH3:67].[CH:29]1([P:30]([CH:31]2[CH2:32][CH2:33][CH2:34][CH2:35][CH2:36]2)[c:37]2[cH:38][cH:39][cH:40][cH:41][c:42]2-[c:43]2[c:44]([CH:45]([CH3:46])[CH3:47])[cH:48][c:49]([CH:50]([CH3:51])[CH3:52])[cH:53][c:54]2[CH:55]([CH3:56])[CH3:57])[CH2:58][CH2:59][CH2:60][CH2:61][CH2:62]1.[NH2:1][c:2]1[cH:3][c:4](=[O:19])[nH:5][c:6]2[c:7]([O:14][CH2:15][CH:16]3[CH2:17][CH2:18]3)[c:8]([O:12][CH3:13])[cH:9][cH:10][c:11]12.[Na+:68].[O:107]=[C:108]([CH:109]=[CH:110][c:111]1[cH:112][cH:113][cH:114][cH:115][cH:116]1)[CH:117]=[CH:118][c:119]1[cH:120][cH:121][cH:122][cH:123][cH:124]1.[O:71]=[C:72]([CH:73]=[CH:74][c:75]1[cH:76][cH:77][cH:78][cH:79][cH:80]1)[CH:81]=[CH:82][c:83]1[cH:84][cH:85][cH:86][cH:87][cH:88]1.[O:89]=[C:90]([CH:91]=[CH:92][c:93]1[cH:94][cH:95][cH:96][cH:97][cH:98]1)[CH:99]=[CH:100][c:101]1[cH:102][cH:103][cH:104][cH:105][cH:106]1.[Pd:69].[Pd:70]>>[NH:1]([c:2]1[cH:3][c:4](=[O:19])[nH:5][c:6]2[c:7]([O:14][CH2:15][CH:16]3[CH2:17][CH2:18]3)[c:8]([O:12][CH3:13])[cH:9][cH:10][c:11]12)[c:21]1[c:22]([CH3:28])[cH:23][n:24][cH:25][c:26]1[CH3:27]

Participants

9

Reactant 8

HCID 923Sodium ionHCID 1140TolueneHCID 23938Palladium2×HCID 95417Dibenzylidene acetone3×HCID 45749132-Methylpropan-2-olateHCID 111557942-Dicyclohexylphosphino-2',4',6'-triisoprophylbiphenylHCID 223232464-Bromo-3,5-dimethylpyridineHCID 592681194-amino-8-(cyclopropylmethoxy)-7-methoxyquinolin-2(1H)-one

Product 1

HCID 236492908-(cyclopropylmethoxy)-4-(3,5-dimethylpyridin-4-ylamino)-7-methoxyquinolin-2(1H)-one

Sources & evidence

ORD record
ord-d6832c0516704b4fb22e6a53c2e5852f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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