Trifluoroacetic acid → 2-(4-[1,4]Diazepan-1-yl-3-methoxy-phenyl)-6-[(S)-1-(tetrahydro-furan-2-yl)methoxy]-2H-isoquinolin-1-one

HRID 69515Notes

Reaction equation

HRID 69515 reaction equation
C(OC([N:8]1[CH2:14][CH2:13][CH2:12][N:11]([C:15]2[CH:20]=[CH:19][C:18]([N:21]3[CH:30]=[CH:29][C:28]4[C:23](=[CH:24][CH:25]=[C:26]([O:31][CH2:32][C@@H:33]5[CH2:37][CH2:36][CH2:35][O:34]5)[CH:27]=4)[C:22]3=[O:38])=[CH:17][C:16]=2[O:39][CH3:40])[CH2:10][CH2:9]1)=O)(C)(C)C.FC(F)(F)C(O)=O>>[N:11]1([C:15]2[CH:20]=[CH:19][C:18]([N:21]3[CH:30]=[CH:29][C:28]4[C:23](=[CH:24][CH:25]=[C:26]([O:31][CH2:32][C@@H:33]5[CH2:37][CH2:36][CH2:35][O:34]5)[CH:27]=4)[C:22]3=[O:38])=[CH:17][C:16]=2[O:39][CH3:40])[CH2:12][CH2:13][CH2:14][NH:8][CH2:9][CH2:10]1

Participants

3

Reactant 2

HCID 6422Trifluoroacetic acidHCID 689914974-(2-Methoxy-4-{1-oxo-6-[(S)-1-(tetrahydro-furan-2-yl)methoxy]-1H-isoquinolin-2-yl}-phenyl)-[1,4]diazepane-1-carboxylic acid tert-butyl ester

Product 1

HCID 689913772-(4-[1,4]Diazepan-1-yl-3-methoxy-phenyl)-6-[(S)-1-(tetrahydro-furan-2-yl)methoxy]-2H-isoquinolin-1-one

Procedure

Reaction of 4-(2-Methoxy-4-{1-oxo-6-[(S)-1-(tetrahydro-furan-2-yl)methoxy]-1H-isoquinolin-2-yl}-phenyl)-[1,4]diazepane-1-carboxylic acid tert-butyl ester with trifluoroacetic acid by method H2 resulted in the desired product with the molecular weight of 449.55 (C26H31N3O4); MS (ESI): 450 (M+H+).

Sources & evidence

ORD record
ord-34e0daf95a974280aed442eaaf793bc8
Source dataset
uspto-grants-2014_09
Patent number
US08822495B2

Reaction notes

Loading…