Sodium ion → [1-(2-fluoro-2-methylpropyl)-5-oxido-1H-imidazo[4,5-c][1,5]naphthyridin-2-yl]methyl acetate

HRID 171409Notes

Reaction equation

HRID 171409 reaction equation
[C:1]([CH3:2])(=[O:3])[O:4][CH2:5][c:6]1[n:7]([CH2:19][C:20]([CH3:21])([CH3:22])[F:23])[c:8]2[c:9]([cH:10][n:11][c:12]3[cH:13][cH:14][cH:15][n:16][c:17]23)[n:18]1.[C:35](=[O:36])([O-:37])[O-:38].[Cl:41][CH2:42][Cl:43].[Na+:39].[Na+:40].[OH:24][O:25][C:26]([c:27]1[cH:28][c:29]([Cl:30])[cH:31][cH:32][cH:33]1)=[O:34]>>[C:1]([CH3:2])(=[O:3])[O:4][CH2:5][c:6]1[n:7]([CH2:19][C:20]([CH3:21])([CH3:22])[F:23])[c:8]2[c:9]([cH:10][n+:11]([O-:24])[c:12]3[cH:13][cH:14][cH:15][n:16][c:17]23)[n:18]1

Participants

6

Reactant 5

HCID 923Sodium ion2×HCID 6344DichloromethaneHCID 19660Carbonate IonHCID 70297m-Chloroperbenzoic acidHCID 68933078HCID 68933078, compound

Product 1

HCID 68935317[1-(2-fluoro-2-methylpropyl)-5-oxido-1H-imidazo[4,5-c][1,5]naphthyridin-2-yl]methyl acetate

Sources & evidence

ORD record
ord-1585dcb2dee14f5bbff5cbd588169dca
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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