Hydrochloric Acid → 7-[4-(2-butoxyethoxy)phenyl]-1-formyl-N-[4-[hydroxy(pyridin-2-yl)methyl]phenyl]-2,3-dihydro-1-benzazepine-4-carboxamide

HRID 313392Notes

Reaction equation

HRID 313392 reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][CH2:6][CH2:7][O:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][cH:17][c:18]3[c:19]([cH:30]2)[CH:20]=[C:21]([C:27](=[O:28])[OH:29])[CH2:22][CH2:23][N:24]3[CH:25]=[O:26])[cH:13][cH:14]1.[CH2:42]([N:43]=[C:44]=[N:45][CH2:46][CH2:47][CH2:48][N:49]([CH3:50])[CH3:51])[CH3:52].[CH3:74][CH2:75][N:76]([CH2:77][CH3:78])[CH2:79][CH3:80].[ClH:41].[NH2:53][c:54]1[cH:55][cH:56][c:57]([CH:60]([OH:61])[c:62]2[n:63][cH:64][cH:65][cH:66][cH:67]2)[cH:58][cH:59]1.[O:68]=[CH:69][N:70]([CH3:71])[CH3:72].[OH2:73].[OH:31][n:32]1[c:33]2[cH:34][cH:35][cH:36][cH:37][c:38]2[n:39][n:40]1>>[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][CH2:6][CH2:7][O:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][cH:17][c:18]3[c:19]([cH:30]2)[CH:20]=[C:21]([C:27](=[O:29])[NH:53][c:54]2[cH:55][cH:56][c:57]([CH:60]([OH:61])[c:62]4[n:63][cH:64][cH:65][cH:66][cH:67]4)[cH:58][cH:59]2)[CH2:22][CH2:23][N:24]3[CH:25]=[O:26])[cH:13][cH:14]1

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 962WaterHCID 6228DimethylformamideHCID 8471TriethylamineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 10420323(4-Aminophenyl) (2-pyridyl)methanolHCID 223290837-[4-(2-butoxyethoxy)phenyl]-1-formyl-2,3-dihydro-1H-1-benzazepine-4-carboxylic acid

Product 1

HCID 878713627-[4-(2-butoxyethoxy)phenyl]-1-formyl-N-[4-[hydroxy(pyridin-2-yl)methyl]phenyl]-2,3-dihydro-1-benzazepine-4-carboxamide

Sources & evidence

ORD record
ord-8fe8a7b80a884dbe912d0ad6d4eddf8e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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