Potassium Cation → 7'-(2-Fluoro-3-pyridinyl)-3'-(2-fluoro-4-pyridinyl)spiro[5,6-dihydro-1,3-oxazine-4,5'-chromeno[2,3-b]pyridine]-2-amine

HRID 702186Notes

Reaction equation

HRID 702186 reaction equation
[Br:19][c:20]1[cH:21][c:22]2[c:23]([n:24][cH:25]1)[O:26][c:27]1[cH:28][cH:29][c:30](-[c:40]3[c:41]([F:46])[n:42][cH:43][cH:44][cH:45]3)[cH:31][c:32]1[C:33]21[N:34]=[C:35]([NH2:39])[O:36][CH2:37][CH2:38]1.[CH3:54][OH:55].[Cl:56][CH2:57][Cl:58].[F:9][c:10]1[n:11][cH:12][cH:13][c:14]([B:16]([OH:17])[OH:18])[cH:15]1.[K+:6].[K+:7].[K+:8].[O:48]1[CH2:49][CH2:50][O:51][CH2:52][CH2:53]1.[OH2:47].[P:1]([O-:2])([O-:3])([O-:4])=[O:5]>>[F:9][c:10]1[n:11][cH:12][cH:13][c:14](-[c:20]2[cH:21][c:22]3[c:23]([n:24][cH:25]2)[O:26][c:27]2[cH:28][cH:29][c:30](-[c:40]4[c:41]([F:46])[n:42][cH:43][cH:44][cH:45]4)[cH:31][c:32]2[C:33]32[N:34]=[C:35]([NH2:39])[O:36][CH2:37][CH2:38]2)[cH:15]1

Participants

9

Reactant 8

HCID 813Potassium Cation3×HCID 887MethanolHCID 962WaterHCID 1061PhosphateHCID 6344DichloromethaneHCID 312751,4-DioxaneHCID 27833962-Fluoropyridine-4-boronic acidHCID 584658843-Bromo-7-(2-fluoropyridin-3-yl)-5',6'-dihydrospiro[chromeno[2,3-b]pyridine-5,4'-[1,3]oxazin]-2'-amine

Product 1

HCID 533908117'-(2-Fluoro-3-pyridinyl)-3'-(2-fluoro-4-pyridinyl)spiro[5,6-dihydro-1,3-oxazine-4,5'-chromeno[2,3-b]pyridine]-2-amine

Sources & evidence

ORD record
ord-c5ce1de9a8574fce8bdba3ab3ebf416c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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