Hydrochloric Acid → Hydrochloric Acid

HRID 174199Notes

Reaction equation

HRID 174199 reaction equation
[CH3:37][OH:38].[CH:1]1([NH:4][C:5](=[O:6])[c:7]2[cH:8][cH:9][c:10]([CH3:35])[c:11](-[c:13]3[cH:14][c:15]4[cH:16][n:17][n:18]([CH:22]5[CH2:23][CH2:24][N:25]([C:28]([O:29][C:30]([CH3:31])([CH3:32])[CH3:33])=[O:34])[CH2:26][CH2:27]5)[c:19]4[cH:20][cH:21]3)[cH:12]2)[CH2:2][CH2:3]1.[ClH:36].[O:39]1[CH2:40][CH2:41][O:42][CH2:43][CH2:44]1>>[CH:1]1([NH:4][C:5](=[O:6])[c:7]2[cH:8][cH:9][c:10]([CH3:35])[c:11](-[c:13]3[cH:14][c:15]4[cH:16][n:17][n:18]([CH:22]5[CH2:23][CH2:24][NH:25][CH2:26][CH2:27]5)[c:19]4[cH:20][cH:21]3)[cH:12]2)[CH2:2][CH2:3]1.[ClH:36]

Participants

6

Reactant 4

HCID 313Hydrochloric AcidHCID 887MethanolHCID 312751,4-DioxaneHCID 586565121,1-Dimethylethyl 4-(5-{5-[(cyclopropylamino)carbonyl]-2-methylphenyl}-1H-indazol-1-yl)-1-piperidinecarboxylate

Product 2

HCID 313Hydrochloric AcidHCID 58656529N-cyclopropyl-4-methyl-3-(1-piperidin-4-ylindazol-5-yl)benzamide

Sources & evidence

ORD record
ord-17c8a80d892440d9914f0d71341d28dd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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