Hydrochloric Acid → HCID 57874453, compound

HRID 2146140Notes

Reaction equation

HRID 2146140 reaction equation
[CH3:10][c:11]1[n:12][n:13][c:14](-[c:16]2[cH:17][cH:18][c:19]([C:20](=[O:21])[OH:22])[cH:23][cH:24]2)[o:15]1.[CH3:35][CH2:36][N:37]=[C:38]=[N:39][CH2:40][CH2:41][CH2:42][N:43]([CH3:44])[CH3:45].[CH:1]([N:2]([CH2:3][CH3:4])[CH:5]([CH3:6])[CH3:7])([CH3:8])[CH3:9].[ClH:46].[NH2:47][CH2:48][C:49](=[O:50])[N:51]1[CH2:52][CH2:53][CH:54]([O:57][c:58]2[c:59]([Cl:64])[cH:60][cH:61][cH:62][cH:63]2)[CH2:55][CH2:56]1.[O:65]=[CH:66][N:67]([CH3:68])[CH3:69].[OH2:70].[OH:25][n:26]1[c:27]2[c:28]([cH:29][cH:30][cH:31][cH:32]2)[n:33][n:34]1>>[CH3:10][c:11]1[n:12][n:13][c:14](-[c:16]2[cH:17][cH:18][c:19]([C:20](=[O:22])[NH:47][CH2:48][C:49](=[O:50])[N:51]3[CH2:52][CH2:53][CH:54]([O:57][c:58]4[c:59]([Cl:64])[cH:60][cH:61][cH:62][cH:63]4)[CH2:55][CH2:56]3)[cH:23][cH:24]2)[o:15]1

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 962WaterHCID 6228DimethylformamideHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 177237644-(5-Methyl-1,3,4-oxadiazol-2-yl)benzoic acidHCID 593762772-Amino-1-[4-(2-chlorophenoxy)piperidin-1-yl]ethanone

Product 1

HCID 57874453HCID 57874453, compound

Sources & evidence

ORD record
ord-d153c9bc24074b2194c512c3d9c72543
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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