Hydrochloric Acid → 3-[4-(4-Phenyl-piperidin-1-yl)-benzenesulfonylamino]-propionic acid

HRID 112800Notes

Reaction equation

HRID 112800 reaction equation
[CH3:37][S:38](=[O:39])[CH3:40].[ClH:18].[F:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH:11][CH2:12][CH2:13][C:14](=[O:15])[OH:16])[cH:6][cH:7]1.[Na+:31].[Na+:32].[Na:17].[O-:33][C:34](=[O:35])[O-:36].[c:19]1([CH:25]2[CH2:26][CH2:27][NH:28][CH2:29][CH2:30]2)[cH:20][cH:21][cH:22][cH:23][cH:24]1>>[c:2]1([N:28]2[CH2:27][CH2:26][CH:25]([c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[CH2:30][CH2:29]2)[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH:11][CH2:12][CH2:13][C:14](=[O:15])[OH:16])[cH:6][cH:7]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 679Dimethyl SulfoxideHCID 923Sodium ion2×HCID 19660Carbonate IonHCID 698734-PhenylpiperidineHCID 7574113-(4-Fluorobenzenesulfonamido)propanoic acidHCID 5360545Sodium

Product 1

HCID 154328453-[4-(4-Phenyl-piperidin-1-yl)-benzenesulfonylamino]-propionic acid

Sources & evidence

ORD record
ord-973b592940d741079a6c935078535b44
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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