Sodium ion → [4-(2-Amino-5-thiophen-2-yl-phenylcarbamoyl)-benzyl]-phosphonic acid monomethyl ester

HRID 2124262Notes

Reaction equation

HRID 2124262 reaction equation
[CH3:1][O:2][P:3]([O:4][CH3:5])(=[O:6])[CH2:7][c:8]1[cH:9][cH:10][c:11]([C:14]([NH:15][c:16]2[c:17]([NH2:27])[cH:18][cH:19][c:20](-[c:22]3[s:23][cH:24][cH:25][cH:26]3)[cH:21]2)=[O:28])[cH:12][cH:13]1.[F:31][C:32]([F:33])([F:34])[C:35]([OH:36])=[O:37].[Na+:30].[O:38]1[CH2:39][CH2:40][O:41][CH2:42][CH2:43]1.[O:44]=[CH:45][N:46]([CH3:47])[CH3:48].[OH-:29]>>[CH3:1][O:2][P:3](=[O:4])([OH:6])[CH2:7][c:8]1[cH:9][cH:10][c:11]([C:14]([NH:15][c:16]2[c:17]([NH2:27])[cH:18][cH:19][c:20](-[c:22]3[s:23][cH:24][cH:25][cH:26]3)[cH:21]2)=[O:28])[cH:12][cH:13]1

Participants

7

Reactant 6

HCID 923Sodium ionHCID 961HydroxideHCID 6228DimethylformamideHCID 6422Trifluoroacetic acidHCID 312751,4-DioxaneHCID 57925890HCID 57925890, compound

Product 1

HCID 25012817[4-(2-Amino-5-thiophen-2-yl-phenylcarbamoyl)-benzyl]-phosphonic acid monomethyl ester

Sources & evidence

ORD record
ord-2da03c59d4cc4768a2d56e7f96a8a1e9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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