Hydrochloric Acid → Hydrochloric Acid

HRID 2338816Notes

Reaction equation

HRID 2338816 reaction equation
[CH3:39][CH2:40][O:41][C:42]([CH3:43])=[O:44].[CH3:45][OH:46].[Cl:47][CH2:48][Cl:49].[ClH:38].[c:1]1(-[c:7]2[c:8](-[c:20]3[cH:21][cH:22][c:23]([C:26]4([NH:30][C:31](=[O:32])[O:33][C:34]([CH3:35])([CH3:36])[CH3:37])[CH2:27][CH2:28][CH2:29]4)[cH:24][cH:25]3)[n:9][c:10]3[cH:11][cH:12][n:13]4[c:14]([c:15]3[cH:16]2)[n:17][n:18][cH:19]4)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[ClH:38].[c:1]1(-[c:7]2[c:8](-[c:20]3[cH:21][cH:22][c:23]([C:26]4([NH2:30])[CH2:27][CH2:28][CH2:29]4)[cH:24][cH:25]3)[n:9][c:10]3[cH:11][cH:12][n:13]4[c:14]([c:15]3[cH:16]2)[n:17][n:18][cH:19]4)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

7

Reactant 5

HCID 313Hydrochloric AcidHCID 887MethanolHCID 6344DichloromethaneHCID 8857Ethyl AcetateHCID 57805513HCID 57805513, compound

Product 2

HCID 313Hydrochloric AcidHCID 248095561-[4-(9-Phenyl-[1,2,4]triazolo[3,4-f][1,6]naphthyridin-8-yl)phenyl]cyclobutan-1-amine

Sources & evidence

ORD record
ord-6d4deed8bdd14045a3a9afab438c5c4c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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