Potassium Cation → rac 5-Desfluoro Voriconazole

HRID 1121216Notes

Reaction equation

HRID 1121216 reaction equation
[C:35](=[O:36])([O-:37])[O-:38].[CH3:1][S:2](=[O:3])(=[O:4])[Cl:5].[CH3:51][OH:52].[CH3:53][N:54]([CH3:55])[CH:56]=[O:57].[CH:26]([N:27]([CH:28]([CH3:29])[CH3:30])[CH2:31][CH3:32])([CH3:33])[CH3:34].[F:6][c:7]1[c:8]([C:14]([CH2:15][OH:16])([CH:17]([CH3:18])[c:19]2[n:20][cH:21][n:22][cH:23][cH:24]2)[OH:25])[cH:9][cH:10][c:11]([F:13])[cH:12]1.[K+:39].[K+:40].[O:46]1[CH2:47][CH2:48][CH2:49][CH2:50]1.[nH:41]1[n:42][cH:43][n:44][cH:45]1>>[F:6][c:7]1[c:8]([C:14]([CH2:15][n:41]2[n:42][cH:43][n:44][cH:45]2)([CH:17]([CH3:18])[c:19]2[n:20][cH:21][n:22][cH:23][cH:24]2)[OH:25])[cH:9][cH:10][c:11]([F:13])[cH:12]1

Participants

10

Reactant 9

HCID 813Potassium Cation2×HCID 887MethanolHCID 6228DimethylformamideHCID 8028TetrahydrofuranHCID 92571H-1,2,4-TriazoleHCID 19660Carbonate IonHCID 31297Methanesulfonyl chlorideHCID 81531DiisopropylethylamineHCID 178436814HCID 178436814, compound

Product 1

HCID 22323347rac 5-Desfluoro Voriconazole

Sources & evidence

ORD record
ord-a3242d61a2524afd8172c1e38dc4afa1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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