3,4-Dimethylphenol → HCID 69417266, compound

HRID 1293249Notes

Reaction equation

HRID 1293249 reaction equation
Cl[C:2]1[C:7]([C:8]([NH:10][C@H:11]([C:13]2[CH:22]=[CH:21][C:16]([C:17]([O:19][CH3:20])=[O:18])=[CH:15][CH:14]=2)[CH3:12])=[O:9])=[CH:6][C:5]([Cl:23])=[CH:4][N:3]=1.[CH3:24][C:25]1[CH:26]=[C:27]([OH:32])[CH:28]=[CH:29][C:30]=1[CH3:31]>>[Cl:23][C:5]1[CH:6]=[C:7]([C:8]([NH:10][C@H:11]([C:13]2[CH:22]=[CH:21][C:16]([C:17]([O:19][CH3:20])=[O:18])=[CH:15][CH:14]=2)[CH3:12])=[O:9])[C:2]([O:32][C:27]2[CH:28]=[CH:29][C:30]([CH3:31])=[C:25]([CH3:24])[CH:26]=2)=[N:3][CH:4]=1

Participants

3

Reactant 2

HCID 72493,4-DimethylphenolHCID 86601543Methyl 4-((1S)-1-{[(2,5-dichloropyridin-3-yl)carbonyl]amino}ethyl)benzoate

Product 1

HCID 69417266HCID 69417266, compound

Procedure

The title compound was prepared according to the procedure described in step 2 of Example 45 from methyl 4-((1S)-1-{[(2,5-dichloropyridin-3-yl)carbonyl]amino}ethyl)benzoate (step 1 of Example 48) and 3,4-dimethylphenol: 1H-NMR (CDCl3) δ 8.54 (1H, d, J=2.6 Hz), 8.26 (1H, d, J=7.4 Hz), 8.14 (1H, d, J=2.6 Hz), 8.00 (2H, dd, J=6.6, 1.8 Hz), 7.42 (2H, d, J=8.4 Hz), 7.22 (1H, d, J=8.1 Hz), 6.97–6.87 (2H, m), 5.42–5.32 (1H, m), 3.90 (3H, s), 2.29 (6H, s), 1.58 (3H, d, J=7.1 Hz).

Sources & evidence

ORD record
ord-6459383aaa4d42998b45061a8cddedb5
Source dataset
uspto-grants-2007_07
Patent number
US07238714B2

Reaction notes

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