Bicarbonate Ion → N-[3-[5-amino-3,6-dimethyl-6-(trifluoromethyl)-2H-1,4-oxazin-3-yl]-4-fluorophenyl]-5-cyano-3-methylpyridine-2-carboxamide

HRID 304919Notes

Reaction equation

HRID 304919 reaction equation
[C:1]([O:2][C:3](=[O:4])[NH:7][C:8]1=[N:13][C:12]([CH3:14])([c:15]2[c:16]([F:33])[cH:17][cH:18][c:19]([NH:21][C:22](=[O:23])[c:24]3[n:25][cH:26][c:27]([C:31]#[N:32])[cH:28][c:29]3[CH3:30])[cH:20]2)[CH2:11][O:10][C:9]1([C:34]([F:35])([F:36])[F:37])[CH3:38])([CH3:5])([CH3:6])[CH3:39].[Cl:52][CH2:53][Cl:54].[F:40][C:41]([F:42])([F:43])[C:44]([OH:45])=[O:46].[Na+:51].[O-:47][C:48]([OH:49])=[O:50]>>[NH2:7][C:8]1=[N:13][C:12]([CH3:14])([c:15]2[c:16]([F:33])[cH:17][cH:18][c:19]([NH:21][C:22](=[O:23])[c:24]3[n:25][cH:26][c:27]([C:31]#[N:32])[cH:28][c:29]3[CH3:30])[cH:20]2)[CH2:11][O:10][C:9]1([C:34]([F:35])([F:36])[F:37])[CH3:38]

Participants

6

Reactant 5

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 178426500HCID 178426500, compound

Product 1

HCID 71140931N-[3-[5-amino-3,6-dimethyl-6-(trifluoromethyl)-2H-1,4-oxazin-3-yl]-4-fluorophenyl]-5-cyano-3-methylpyridine-2-carboxamide

Sources & evidence

ORD record
ord-574cf47696fb453a94a847374a91981b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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