1-Tert-butyl-4-isocyanatobenzene → 1-[4-(6-Amino-pyrimidin-4-ylmethyl)-phenyl]-3-(4-tert-butyl-phenyl)-urea

HRID 1993597Notes

Reaction equation

HRID 1993597 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.[C:27]([C:31]1[CH:36]=[CH:35][C:34]([N:37]=[C:38]=[O:39])=[CH:33][CH:32]=1)([CH3:30])([CH3:29])[CH3:28]>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:38]([NH:37][C:34]3[CH:35]=[CH:36][C:31]([C:27]([CH3:30])([CH3:28])[CH3:29])=[CH:32][CH:33]=3)=[O:39])=[CH:11][CH:10]=2)[CH:3]=1

Participants

4

Reactant 2

HCID 27356951-Tert-butyl-4-isocyanatobenzeneHCID 58659424HCID 58659424, compound

Product 1

HCID 586594331-[4-(6-Amino-pyrimidin-4-ylmethyl)-phenyl]-3-(4-tert-butyl-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-tert-butyl-phenyl-isocyanate, and DMF as the solvent. The reaction mixture is stirred for 3 h. The title compound is obtained as a white solid: ES-MS: 348.0 [M+H]+; single peak at tR=6.94 min (System 2).

Workup

  1. customThe title compound is prepared

Sources & evidence

ORD record
ord-2fc3a830d4474048ab6912b4b1ee17cf
Source dataset
uspto-grants-2010_01
Patent number
US07652022B2

Reaction notes

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