Hydrochloric Acid → HCID 12796037, compound

Reaction equation

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

Participants

Reactant 4

HCID 313Hydrochloric Acid

HCID 3776Isopropanol

HCID 809774-Chloro-2-phenylquinazoline

HCID 131050292,5-Dimethyl-1-(2-pyridinyl)piperazine

Product 1

HCID 12796037HCID 12796037, compound

Sources & evidence

ORD record: ord-be64c17c47cb45e6ba14d475552bc660
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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