Hydrochloric Acid → Ethyl 4-[7-(5-{3-chloro-4-[(1-methylethyl)oxy]phenyl}-1,2,4-oxadiazol-3-yl)-1,2,4,5-tetrahydro-3H-3-benzazepin-3-yl]butanoate

HRID 806796Notes

Reaction equation

HRID 806796 reaction equation
[Br:38][CH2:39][CH2:40][CH2:41][C:42](=[O:43])[O:44][CH2:45][CH3:46].[CH:29]([N:30]([CH2:31][CH3:32])[CH:33]([CH3:34])[CH3:35])([CH3:36])[CH3:37].[Cl:2][c:3]1[cH:4][c:5](-[c:13]2[n:14][c:15](-[c:18]3[cH:19][c:20]4[c:21]([cH:27][cH:28]3)[CH2:22][CH2:23][NH:24][CH2:25][CH2:26]4)[n:16][o:17]2)[cH:6][cH:7][c:8]1[O:9][CH:10]([CH3:11])[CH3:12].[ClH:1].[O:47]=[CH:48][N:49]([CH3:50])[CH3:51]>>[Cl:2][c:3]1[cH:4][c:5](-[c:13]2[n:14][c:15](-[c:18]3[cH:19][c:20]4[c:21]([cH:27][cH:28]3)[CH2:22][CH2:23][N:24]([CH2:39][CH2:40][CH2:41][C:42](=[O:43])[O:44][CH2:45][CH3:46])[CH2:25][CH2:26]4)[n:16][o:17]2)[cH:6][cH:7][c:8]1[O:9][CH:10]([CH3:11])[CH3:12]

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 76300Ethyl 4-bromobutyrateHCID 81531DiisopropylethylamineHCID 441289045-(3-chloro-4-propan-2-yloxyphenyl)-3-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)-1,2,4-oxadiazole

Product 1

HCID 59403483Ethyl 4-[7-(5-{3-chloro-4-[(1-methylethyl)oxy]phenyl}-1,2,4-oxadiazol-3-yl)-1,2,4,5-tetrahydro-3H-3-benzazepin-3-yl]butanoate

Sources & evidence

ORD record
ord-6dd834bd87244572acf19ee10bcc8e96
Source dataset
Test data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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