Potassium Cation → (7-Chlorospiro[benzo[b]pyrrolo[1,2-d][1,4]oxazine-4,4'-piperidine]-1'-yl)(4-cyclopropyl-3-methoxyphenyl)methanone

HRID 313088Notes

Reaction equation

HRID 313088 reaction equation
[Br:1][c:2]1[c:3]([O:29][CH3:30])[cH:4][c:5]([C:8](=[O:9])[N:10]2[CH2:11][CH2:12][C:13]3([c:14]4[n:15]([cH:24][cH:25][cH:26]4)-[c:16]4[c:17]([cH:19][c:20]([Cl:23])[cH:21][cH:22]4)[O:18]3)[CH2:27][CH2:28]2)[cH:6][cH:7]1.[CH:31]1([B:34]([OH:35])[OH:36])[CH2:32][CH2:33]1.[K+:37].[K+:38].[O-:39][C:40]([O-:41])=[O:42].[O:43]=[CH:44][N:45]([CH3:46])[CH3:47]>>[c:2]1([CH:31]2[CH2:32][CH2:33]2)[c:3]([O:29][CH3:30])[cH:4][c:5]([C:8](=[O:9])[N:10]2[CH2:11][CH2:12][C:13]3([c:14]4[n:15]([cH:24][cH:25][cH:26]4)-[c:16]4[c:17]([cH:19][c:20]([Cl:23])[cH:21][cH:22]4)[O:18]3)[CH2:27][CH2:28]2)[cH:6][cH:7]1

Participants

6

Reactant 5

HCID 813Potassium Cation2×HCID 6228DimethylformamideHCID 19660Carbonate IonHCID 2760897Cyclopropylboronic acidHCID 58551353(4-Bromo-3-methoxy-phenyl)-(7'-chlorospiro[piperidine-4,4'-pyrrolo[2,1-c][1,4]benzoxazine]-1-yl)methanone

Product 1

HCID 58551518(7-Chlorospiro[benzo[b]pyrrolo[1,2-d][1,4]oxazine-4,4'-piperidine]-1'-yl)(4-cyclopropyl-3-methoxyphenyl)methanone

Sources & evidence

ORD record
ord-d57a57a35882440caa36696820075c1c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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