Methanol → 3-[(4-Hydroxy-cyclohexyl)-(4-methyl-cyclohexanecarbonyl)-amino]-5-phenyl-thiophene-2-carboxylic acid methyl ester

HRID 165106Notes

Reaction equation

HRID 165106 reaction equation
[BH4-:33].[CH3:1][O:2][C:3](=[O:4])[c:5]1[s:6][c:7](-[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[cH:8][c:9]1[N:10]([CH:11]1[CH2:12][CH2:13][C:14](=[O:17])[CH2:15][CH2:16]1)[C:18](=[O:19])[CH:20]1[CH2:21][CH2:22][CH:23]([CH3:26])[CH2:24][CH2:25]1.[CH3:35][OH:36].[Na+:34]>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[s:6][c:7](-[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[cH:8][c:9]1[N:10]([CH:11]1[CH2:12][CH2:13][CH:14]([OH:17])[CH2:15][CH2:16]1)[C:18](=[O:19])[CH:20]1[CH2:21][CH2:22][CH:23]([CH3:26])[CH2:24][CH2:25]1

Participants

5

Reactant 4

HCID 887MethanolHCID 923Sodium ionHCID 28123BorohydrideHCID 597523053-[(4-Methyl-cyclohexanecarbonyl)-(4-oxo-cyclohexyl)-amino]-5-phenyl-thiophene-2-carboxylic acid methyl ester

Product 1

HCID 597523083-[(4-Hydroxy-cyclohexyl)-(4-methyl-cyclohexanecarbonyl)-amino]-5-phenyl-thiophene-2-carboxylic acid methyl ester

Sources & evidence

ORD record
ord-57145f7b601941f3aa2475fde1c96c73
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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