7-Isoquinolinol → HCID 69416321, compound

HRID 1293327Notes

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.[CH:24]1[C:33]2[C:28](=[CH:29][CH:30]=[C:31]([OH:34])[CH:32]=2)[CH:27]=[CH:26][N:25]=1>>[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:34][C:31]2[CH:32]=[C:33]3[C:28]([CH:27]=[CH:26][N:25]=[CH:24]3)=[CH:29][CH:30]=2)=[N:3][CH:4]=1

Participants

Reactant 2

HCID 4597677-Isoquinolinol

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

Product 1

HCID 69416321HCID 69416321, compound

Procedure

The title compound was prepared according to the procedure described in step 2 of Example 45 methyl 4-((1S)-1-{[(2,5-dichloropyridin-3-yl)carbonyl]amino}ethyl)benzoate (step 1 of Example 48) and isoquinolin-7-ol: 1H-NMR (CDCl3) δ 9.27 (1H, s), 8.59 (2H, m), 8.13–8.10 (2H, m), 8.00 (2H, d, J=8.4 Hz), 7.94 (1H, d, J=8.9 Hz), 7.74 (2H, m), 7.50 (1H, dd, J=8.9, 2.3 Hz), 7.45 (2H, d, J=8.4 Hz), 5.40 (1H, m), 3.89 (3H, s), 1.61 (3H, d, J=7.0 Hz).

Sources & evidence

ORD record: ord-98710ef9e7a64a5c83433a12f6d90121
Source dataset: uspto-grants-2007_07
DOI: 10.6084/m9.figshare.5104873.v1
Patent number: US07238714B2

Reaction notes

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