Hydrochloric Acid → 2-hydroxy-1-(4-((2-(1-isopropyl-1H-1,2,4-triazol-5-yl)-4,5-dihydrobenzo[b]pyrazolo[1,5-d][1,4]oxazepin-9-yl)methyl)piperazin-1-yl)ethanone

HRID 804328Notes

Reaction equation

HRID 804328 reaction equation
[CH3:36][CH2:37][O:38][CH2:39][CH3:40].[CH:12]([CH3:13])([CH3:14])[n:15]1[n:16][cH:17][n:18][c:19]1-[c:20]1[cH:21][c:22]2[n:28]([n:29]1)-[c:27]1[c:26]([cH:33][cH:32][c:31]([CH:34]=[O:35])[cH:30]1)[O:25][CH2:24][CH2:23]2.[ClH:1].[OH:2][CH2:3][C:4](=[O:5])[N:6]1[CH2:7][CH2:8][NH:9][CH2:10][CH2:11]1>>[OH:2][CH2:3][C:4](=[O:5])[N:6]1[CH2:7][CH2:8][N:9]([CH2:34][c:31]2[cH:30][c:27]3[c:26]([cH:33][cH:32]2)[O:25][CH2:24][CH2:23][c:22]2[cH:21][c:20](-[c:19]4[n:15]([CH:12]([CH3:13])[CH3:14])[n:16][cH:17][n:18]4)[n:29][n:28]2-3)[CH2:10][CH2:11]1

Participants

5

Reactant 4

HCID 313Hydrochloric AcidHCID 3283Diethyl EtherHCID 185068842-Hydroxy-1-(piperazin-1-yl)ethan-1-oneHCID 582046662-(2-isopropyl-2H-[1,2,4]triazol-3-yl)-4,5-dihydro-6-oxa-1,10b-diaza-benzo[e]azulene-9-carbaldehyde

Product 1

HCID 582047252-hydroxy-1-(4-((2-(1-isopropyl-1H-1,2,4-triazol-5-yl)-4,5-dihydrobenzo[b]pyrazolo[1,5-d][1,4]oxazepin-9-yl)methyl)piperazin-1-yl)ethanone

Sources & evidence

ORD record
ord-471edfd71f624aaabc95a5eb5a162d5d
Source dataset
Test data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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