Hydrochloric Acid → 6-Chloro-4-(4-{[(3,4-dichloro-5-methyl-1H-pyrrol-2-yl)carbonyl]amino}piperidin-1-yl)quinoline-2-carboxylic acid

HRID 155184Notes

Reaction equation

HRID 155184 reaction equation
[CH2:36]1[O:37][CH2:38][CH2:39][CH2:40]1.[CH3:41][OH:42].[Cl:1][c:2]1[cH:3][c:4]2[c:5]([N:16]3[CH2:17][CH2:18][CH:19]([NH:22][C:23](=[O:24])[c:25]4[nH:26][c:27]([CH3:32])[c:28]([Cl:31])[c:29]4[Cl:30])[CH2:20][CH2:21]3)[cH:6][c:7]([C:12](=[O:13])[O:14][CH3:15])[n:8][c:9]2[cH:10][cH:11]1.[ClH:35].[Na+:34].[OH-:33].[OH2:43]>>[Cl:1][c:2]1[cH:3][c:4]2[c:5]([N:16]3[CH2:17][CH2:18][CH:19]([NH:22][C:23](=[O:24])[c:25]4[nH:26][c:27]([CH3:32])[c:28]([Cl:31])[c:29]4[Cl:30])[CH2:20][CH2:21]3)[cH:6][c:7]([C:12](=[O:13])[OH:14])[n:8][c:9]2[cH:10][cH:11]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 68582528HCID 68582528, compound

Product 1

HCID 113750776-Chloro-4-(4-{[(3,4-dichloro-5-methyl-1H-pyrrol-2-yl)carbonyl]amino}piperidin-1-yl)quinoline-2-carboxylic acid

Sources & evidence

ORD record
ord-521aeb9a73c44649a09a9dc490540bc7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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