Hydrochloric Acid → [[[[5-[(2,5-Difluorophenyl)[(4-fluorophenyl)sulfonyl]methyl]-4-methylpyridin-2-yl]carbonyl]amino]methoxy]acetic Acid

HRID 291960Notes

Reaction equation

HRID 291960 reaction equation
[ClH:41].[F:1][c:2]1[c:3]([CH:9]([c:10]2[c:11]([CH3:27])[cH:12][c:13]([C:16](=[O:17])[NH:18][CH2:19][O:20][CH2:21][C:22](=[O:23])[O:24][CH2:25][CH3:26])[n:14][cH:15]2)[S:28](=[O:29])(=[O:30])[c:31]2[cH:32][cH:33][c:34]([F:37])[cH:35][cH:36]2)[cH:4][c:5]([F:8])[cH:6][cH:7]1.[Li+:40].[O:42]1[CH2:43][CH2:44][CH2:45][CH2:46]1.[OH-:39].[OH2:38].[OH2:47]>>[F:1][c:2]1[c:3]([CH:9]([c:10]2[c:11]([CH3:27])[cH:12][c:13]([C:16](=[O:17])[NH:18][CH2:19][O:20][CH2:21][C:22](=[O:23])[OH:24])[n:14][cH:15]2)[S:28](=[O:29])(=[O:30])[c:31]2[cH:32][cH:33][c:34]([F:37])[cH:35][cH:36]2)[cH:4][c:5]([F:8])[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 961HydroxideHCID 962Water2×HCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 57736550Ethyl [[[[5-[(2,5-difluorophenyl)[(4-fluorophenyl)sulfonyl]methyl]-4-methylpyridin-2-yl]carbonyl]amino]methoxy]acetate

Product 1

HCID 57736415[[[[5-[(2,5-Difluorophenyl)[(4-fluorophenyl)sulfonyl]methyl]-4-methylpyridin-2-yl]carbonyl]amino]methoxy]acetic Acid

Sources & evidence

ORD record
ord-73a6cb2f3434406099b822cdfc7ec672
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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