1-Chloro-4-isocyanato-2-(trifluoromethyl) benzene → 1-[4-(6-Amino-pyrimidin-4-ylmethyl)-phenyl]-3-(4-chloro-3-trifluoromethyl-phenyl)-urea

HRID 1993596Notes

Reaction equation

HRID 1993596 reaction equation
[NH2:1][C:2]1[N:7]=[CH:6][N:5]=[C:4]([CH2:8][C:9]2[CH:14]=[CH:13][C:12]([NH:15]C(NC3C=CC(CC)=CC=3)=O)=[CH:11][CH:10]=2)[CH:3]=1.[Cl:27][C:28]1[CH:33]=[CH:32][C:31]([N:34]=[C:35]=[O:36])=[CH:30][C:29]=1[C:37]([F:40])([F:39])[F:38]>CN(C=O)C>[NH2:1][C:2]1[N:7]=[CH:6][N:5]=[C:4]([CH2:8][C:9]2[CH:14]=[CH:13][C:12]([NH:15][C:35]([NH:34][C:31]3[CH:32]=[CH:33][C:28]([Cl:27])=[C:29]([C:37]([F:38])([F:39])[F:40])[CH:30]=3)=[O:36])=[CH:11][CH:10]=2)[CH:3]=1

Participants

4

Reactant 2

HCID 27332651-Chloro-4-isocyanato-2-(trifluoromethyl) benzeneHCID 58659424HCID 58659424, compound

Product 1

HCID 586593841-[4-(6-Amino-pyrimidin-4-ylmethyl)-phenyl]-3-(4-chloro-3-trifluoromethyl-phenyl)-urea

Reagents, catalysts & solvents 1

HCID 6228DimethylformamideSolvent

Procedure

The title compound is prepared as described in Example 102 but using 6-(4-aminobenzyl)-pyrimidin-4-ylamine (see Example 157), 4-chloro-3-(trifluoromethyl)-phenyl isocyanate, and DMF as the solvent. The reaction mixture is stirred for 2 h. The title compound is obtained as a white solid: ES-MS: 422.8 [M+H]+; single peak at tR=7.58 min (System 2).

Workup

  1. customThe title compound is prepared

Sources & evidence

ORD record
ord-909ec09e1e9041e293907fa2b147f780
Source dataset
uspto-grants-2010_01
Patent number
US07652022B2

Reaction notes

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