2-Tert-butyl-4-[4-(3-chloropropyl)piperazin-1-yl]-6-(trifluoromethyl)pyrimidine → 2-tert-Butyl-4-{4-[3-(4-methyl-4H-[1,2,4]triazol-3-ylsulfanyl)-propyl]-piperazin-1-yl}-6-trifluoromethyl-pyrimidine hydrochloride

HRID 896225Notes

Reaction equation

HRID 896225 reaction equation
[CH3:1][N:2]1[CH:6]=[N:5][N:4]=[C:3]1[SH:7].[C:8]([C:12]1[N:17]=[C:16]([N:18]2[CH2:23][CH2:22][N:21]([CH2:24][CH2:25][CH2:26][Cl:27])[CH2:20][CH2:19]2)[CH:15]=[C:14]([C:28]([F:31])([F:30])[F:29])[N:13]=1)([CH3:11])([CH3:10])[CH3:9]>>[ClH:27].[C:8]([C:12]1[N:17]=[C:16]([N:18]2[CH2:23][CH2:22][N:21]([CH2:24][CH2:25][CH2:26][S:7][C:3]3[N:2]([CH3:1])[CH:6]=[N:5][N:4]=3)[CH2:20][CH2:19]2)[CH:15]=[C:14]([C:28]([F:29])([F:30])[F:31])[N:13]=1)([CH3:9])([CH3:10])[CH3:11]

Participants

3

Reactant 2

HCID 223498552-Tert-butyl-4-[4-(3-chloropropyl)piperazin-1-yl]-6-(trifluoromethyl)pyrimidineHCID 178481306HCID 178481306, compound

Product 1

HCID 223498682-tert-Butyl-4-{4-[3-(4-methyl-4H-[1,2,4]triazol-3-ylsulfanyl)-propyl]-piperazin-1-yl}-6-trifluoromethyl-pyrimidine hydrochlorideYield 50.3%

Procedure

1 g of 4-methyl-4H-[1,2,4]triazole-3-thiol (8.7 mmol) were reacted with 3.2 g of 2-tert-butyl-4-[4-(3-chloro-propyl)-piperazin-1-yl]-6-trifluoromethyl-pyrimidine (8.7 mmol to yield 2.1 g of the title compound as a solid.

Sources & evidence

ORD record
ord-be745978e9ff47cdb7ffe595126eeb38
Source dataset
uspto-grants-2005_07
Patent number
US06919342B2

Reaction notes

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