Formic Acid → N-hydroxy-N-[5-pyrimidin-2-yl-1-[4-[5-(2,2,2-trifluoroethoxy)pyrimidin-2-yl]piperazin-1-yl]sulfonylpentan-2-yl]formamide

HRID 1139322Notes

Reaction equation

HRID 1139322 reaction equation
[CH2:45]1[O:46][CH2:47][CH2:48][CH2:49]1.[CH3:4][C:5]([O:6][C:7](=[O:8])[CH3:9])=[O:10].[CH:1](=[O:2])[OH:3].[OH:11][NH:12][CH:13]([CH2:14][S:15](=[O:16])(=[O:17])[N:18]1[CH2:19][CH2:20][N:21]([c:24]2[n:25][cH:26][c:27]([O:30][CH2:31][C:32]([F:33])([F:34])[F:35])[cH:28][n:29]2)[CH2:22][CH2:23]1)[CH2:36][CH2:37][CH2:38][c:39]1[n:40][cH:41][cH:42][cH:43][n:44]1>>[CH:1](=[O:2])[N:12]([OH:11])[CH:13]([CH2:14][S:15](=[O:16])(=[O:17])[N:18]1[CH2:19][CH2:20][N:21]([c:24]2[n:25][cH:26][c:27]([O:30][CH2:31][C:32]([F:33])([F:34])[F:35])[cH:28][n:29]2)[CH2:22][CH2:23]1)[CH2:36][CH2:37][CH2:38][c:39]1[n:40][cH:41][cH:42][cH:43][n:44]1

Participants

5

Reactant 4

HCID 284Formic AcidHCID 7918Acetic AnhydrideHCID 8028TetrahydrofuranHCID 866145742-(4-{[2-(Hydroxyamino)-5-pyrimidin-2-ylpentyl]sulfonyl}piperazin-1-yl)-5-(2,2,2-trifluoroethoxy)pyrimidine

Product 1

HCID 57559249N-hydroxy-N-[5-pyrimidin-2-yl-1-[4-[5-(2,2,2-trifluoroethoxy)pyrimidin-2-yl]piperazin-1-yl]sulfonylpentan-2-yl]formamide

Sources & evidence

ORD record
ord-29ad6787b4c04204be1e23385dac9402
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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