Hydrochloric Acid → 5-[2-(2-amino-2-oxoethoxy)-4-methoxy-5-[[1-(1,7-naphthyridin-2-yl)cyclopropyl]carbamoyl]phenyl]-2-(4-fluorophenyl)-N-methyl-1-benzofuran-3-carboxamide

HRID 93682Notes

Reaction equation

HRID 93682 reaction equation
[ClH:51].[NH2:1][C:2]([CH2:3][O:4][c:5]1[cH:6][c:7]([O:34][CH3:35])[c:8]([C:9](=[O:10])[OH:11])[cH:12][c:13]1-[c:14]1[cH:15][cH:16][c:17]2[c:18]([c:19]([C:29]([NH:30][CH3:31])=[O:32])[c:20](-[c:22]3[cH:23][cH:24][c:25]([F:28])[cH:26][cH:27]3)[o:21]2)[cH:33]1)=[O:36].[O:76]=[CH:77][N:78]([CH3:79])[CH3:80].[P-:52]([F:53])([F:54])([F:55])([F:56])([F:57])[F:58].[n:37]1[c:38]([C:47]2([NH2:50])[CH2:48][CH2:49]2)[cH:39][cH:40][c:41]2[cH:42][cH:43][n:44][cH:45][c:46]12.[n:59]1([O:60][C:61]([N:62]([CH3:63])[CH3:64])=[N+:65]([CH3:66])[CH3:67])[c:68]2[n:69][cH:70][cH:71][cH:72][c:73]2[n:74][n:75]1>>[NH2:1][C:2]([CH2:3][O:4][c:5]1[cH:6][c:7]([O:34][CH3:35])[c:8]([C:9](=[O:10])[NH:50][C:47]2([c:38]3[n:37][c:46]4[c:41]([cH:40][cH:39]3)[cH:42][cH:43][n:44][cH:45]4)[CH2:48][CH2:49]2)[cH:12][c:13]1-[c:14]1[cH:15][cH:16][c:17]2[c:18]([c:19]([C:29]([NH:30][CH3:31])=[O:32])[c:20](-[c:22]3[cH:23][cH:24][c:25]([F:28])[cH:26][cH:27]3)[o:21]2)[cH:33]1)=[O:36]

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 666013771-(1,7-Naphthyridin-2-yl)cyclopropanamineHCID 666060174-(2-Amino-2-oxoethoxy)-5-(2-(4-fluorophenyl)-3-(methylcarbamoyl)benzofuran-5-yl)-2-methoxybenzoic acid

Product 1

HCID 533806655-[2-(2-amino-2-oxoethoxy)-4-methoxy-5-[[1-(1,7-naphthyridin-2-yl)cyclopropyl]carbamoyl]phenyl]-2-(4-fluorophenyl)-N-methyl-1-benzofuran-3-carboxamide

Sources & evidence

ORD record
ord-c804b3ed051c49529cbf3d1a99954c54
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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