HCID 68639572, compound → HCID 86732324, compound

HRID 517205Notes

Reaction equation

HRID 517205 reaction equation
[Br:1][C:2]1[CH:7]=[CH:6][C:5]([CH:8]2[C:17]3[C:16](=[O:18])[CH2:15][CH2:14][CH2:13][C:12]=3[N:11]([C:19]3[CH:24]=[CH:23][CH:22]=[C:21]([C:25](F)([F:27])[F:26])[CH:20]=3)[C:10](=[O:29])[NH:9]2)=[C:4]([S:30]([CH3:33])(=[O:32])=[O:31])[CH:3]=1.FC(F)C1C=C(NC(N)=O)C=CC=1>>[Br:1][C:2]1[CH:7]=[CH:6][C:5]([CH:8]2[C:17]3[C:16](=[O:18])[CH2:15][CH2:14][CH2:13][C:12]=3[N:11]([C:19]3[CH:24]=[CH:23][CH:22]=[C:21]([CH:25]([F:26])[F:27])[CH:20]=3)[C:10](=[O:29])[NH:9]2)=[C:4]([S:30]([CH3:33])(=[O:31])=[O:32])[CH:3]=1

Participants

3

Reactant 2

HCID 68639572HCID 68639572, compound2×HCID 86732323HCID 86732323, compound2×

Product 1

HCID 86732324HCID 86732324, compound

Procedure

The title compound is prepared in analogy to 4-(4-bromo-2-(methylsulfonyl)phenyl)-1-(3-(trifluoromethyl)phenyl)-3,4,7,8-tetrahydroquinazoline-2,5(1H,6H)-dione (intermediate 34), using 1-(3-(difluoromethyl)phenyl)urea (intermediate 35, 707 mg, 3.80 mmol) as starting material. Yield: 319 mg; ESI mass spectrum [(79Br)-M+H]+=525, [(81Br)-M+H]+=527, Retention time HPLC: 1.01 min (Z017_S04).

Workup

  1. custom1.01 min (Z017_S04)

Sources & evidence

ORD record
ord-84aa39fef4b248d79c92728c1c74a1cb
Source dataset
uspto-grants-2015_08
Patent number
US09115093B2

Reaction notes

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