Sodium ion → 5-[2-Methoxy-4-(4-methylpiperazin-1-yl)phenyl]-3-oxazolo[4,5-b]pyridin-2-yl-pyridin-2-amine

HRID 2335372Notes

Reaction equation

HRID 2335372 reaction equation
[Br:26][c:27]1[c:28]([O:40][CH3:41])[cH:29][c:30]([N:33]2[CH2:34][CH2:35][N:36]([CH3:39])[CH2:37][CH2:38]2)[cH:31][cH:32]1.[CH3:48][O:49][CH2:50][CH2:51][O:52][CH3:53].[Na+:42].[Na+:43].[O-:44][C:45](=[O:46])[O-:47].[OH2:95].[Pd:54]([Cl:55])[Cl:56].[c:57]1([P:58]([c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)[c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)[cH:71][cH:72][cH:73][cH:74][cH:75]1.[c:76]1([P:77]([c:78]2[cH:79][cH:80][cH:81][cH:82][cH:83]2)[c:84]2[cH:85][cH:86][cH:87][cH:88][cH:89]2)[cH:90][cH:91][cH:92][cH:93][cH:94]1.[o:1]1[c:2](-[c:10]2[c:11]([NH2:25])[n:12][cH:13][c:14]([B:16]3[O:17][C:18]([CH3:19])([CH3:20])[C:21]([CH3:22])([CH3:23])[O:24]3)[cH:15]2)[n:3][c:4]2[n:5][cH:6][cH:7][cH:8][c:9]12>>[o:1]1[c:2](-[c:10]2[c:11]([NH2:25])[n:12][cH:13][c:14](-[c:27]3[c:28]([O:40][CH3:41])[cH:29][c:30]([N:33]4[CH2:34][CH2:35][N:36]([CH3:39])[CH2:37][CH2:38]4)[cH:31][cH:32]3)[cH:15]2)[n:3][c:4]2[n:5][cH:6][cH:7][cH:8][c:9]12

Participants

9

Reactant 8

HCID 923Sodium ion2×HCID 962WaterHCID 80711,2-DimethoxyethaneHCID 11776Triphenylphosphine2×HCID 19660Carbonate IonHCID 24290Palladium ChlorideHCID 673878191-(4-Bromo-3-methoxyphenyl)-4-methylpiperazineHCID 673889723-Oxazolo[4,5-b]pyridin-2-yl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine

Product 1

HCID 673881955-[2-Methoxy-4-(4-methylpiperazin-1-yl)phenyl]-3-oxazolo[4,5-b]pyridin-2-yl-pyridin-2-amine

Sources & evidence

ORD record
ord-5ebd08d0131f477d9063d0cab6f1b2e7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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