Ethanol → HCID 178493702, compound

HRID 2171722Notes

Reaction equation

HRID 2171722 reaction equation
[ClH:1].[CH3:2][CH2:3][OH:4].[F:5][C:6]1[C:19]([N:20]2[CH2:25][CH2:24][N:23]([C:26]3[CH:27]=[N:28][C:29]([N:32]4[CH2:35][CH:34]([O:36][CH3:37])[CH2:33]4)=[N:30][CH:31]=3)[CH2:22][CH2:21]2)=[CH:18][CH:17]=[CH:16]C=1CNC(NC(=O)[O-])=N.C[CH2:39][OH:40]>>[ClH:1].[ClH:1].[ClH:1].[C:29]([NH:32][C:39](=[O:40])[O:4][CH2:3][C:2]1[CH:16]=[CH:17][CH:18]=[C:19]([N:20]2[CH2:21][CH2:22][N:23]([C:26]3[CH:31]=[N:30][C:29]([N:32]4[CH2:35][CH:34]([O:36][CH3:37])[CH2:33]4)=[N:28][CH:27]=3)[CH2:24][CH2:25]2)[C:6]=1[F:5])(=[NH:28])[NH2:30]

Participants

4

Reactant 3

HCID 702EthanolHCID 21887872Ethanol hydrochlorideHCID 178493700HCID 178493700, compound

Product 1

HCID 178493702HCID 178493702, compound

Procedure

A 4M hydrogen chloride/EtOH solution (1.5 ml) was added to a mixture of 2-fluoro-3-{4-[2-(3-methoxyazetidin-1-yl)pyrimidin-5-yl]piperazin-1-yl}benzylcarbamimidoylcarbamate (285 mg) and EtOH (5 ml), followed by stirring at room temperature. The precipitated yellow solid was collected by filtration and washed with EtOH. The obtained solid was dried at 40° C. under reduced pressure to obtain 2-fluoro-3-{4-[2-(3-methoxyazetidin-1-yl)pyrimidin-5-yl]piperazin-1-yl}benzyl carbamimidoylcarbamate trihydrochloride (330 mg).

Workup

  1. filtrationThe precipitated yellow solid was collected by filtration
  2. washwashed with EtOH
  3. customThe obtained solid was dried at 40° C. under reduced pressure

Sources & evidence

ORD record
ord-8ff2610b276648c7b70013b4cd7d6d24
Source dataset
uspto-grants-2015_06
Patent number
US09051283B2

Reaction notes

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