Hydroxy[bis(4-methylphenyl)]acetic acid → N-(2,4-difluoro-5-{1-[3-({hydroxy[bis(4-methylphenyl)]acetyl}amino)propyl]-4-piperidinyl}phenyl)-2-methylpropanamide

HRID 91126Notes

Reaction equation

HRID 91126 reaction equation
[NH2:20][CH2:21][CH2:22][CH2:23][N:24]1[CH2:25][CH2:26][CH:27]([c:30]2[c:31]([F:43])[cH:32][c:33]([F:42])[c:34]([NH:36][C:37]([CH:38]([CH3:39])[CH3:40])=[O:41])[cH:35]2)[CH2:28][CH2:29]1.[OH:1][C:2]([C:3](=[O:4])[OH:5])([c:6]1[cH:7][cH:8][c:9]([CH3:12])[cH:10][cH:11]1)[c:13]1[cH:14][cH:15][c:16]([CH3:19])[cH:17][cH:18]1>>[OH:1][C:2]([C:3](=[O:4])[NH:20][CH2:21][CH2:22][CH2:23][N:24]1[CH2:25][CH2:26][CH:27]([c:30]2[c:31]([F:43])[cH:32][c:33]([F:42])[c:34]([NH:36][C:37]([CH:38]([CH3:39])[CH3:40])=[O:41])[cH:35]2)[CH2:28][CH2:29]1)([c:6]1[cH:7][cH:8][c:9]([CH3:12])[cH:10][cH:11]1)[c:13]1[cH:14][cH:15][c:16]([CH3:19])[cH:17][cH:18]1

Participants

3

Reactant 2

HCID 229097Hydroxy[bis(4-methylphenyl)]acetic acidHCID 16757466N-{5-[1-(3-aminopropyl)-4-piperidinyl]-2,4-difluorophenyl}-2-methylpropanamide

Product 1

HCID 18446853N-(2,4-difluoro-5-{1-[3-({hydroxy[bis(4-methylphenyl)]acetyl}amino)propyl]-4-piperidinyl}phenyl)-2-methylpropanamide

Sources & evidence

ORD record
ord-0f028c63f87d4ba7ac63be6bff95b39a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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