HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Reaction

Water → 4-(2-[4-(4-Methyl-4-(methyldisulphanyl)pentanoyl)piperazin-1-yl]ethoxy)-2,6-bis(hydroxymethyl)pyridine

HRID 1227374
Notes
Print preview

Reaction equation

HRID 1227374 reaction equation
[CH3:1][C:2]([CH2:3][CH2:4][C:5](=[O:6])[OH:7])([CH3:8])[S:9][S:10][CH3:11].[CH:12]([N:13]=[C:14]=[N:15][CH:16]([CH3:17])[CH3:18])([CH3:19])[CH3:20].[N:32]1([CH2:38][CH2:39][O:40][c:41]2[cH:42][c:43]([CH2:49][OH:50])[n:44][c:45]([CH2:47][OH:48])[cH:46]2)[CH2:33][CH2:34][NH:35][CH2:36][CH2:37]1.[O:51]=[CH:52][N:53]([CH3:54])[CH3:55].[OH2:21].[OH:22][n:23]1[c:24]2[cH:25][cH:26][cH:27][cH:28][c:29]2[n:30][n:31]1>>[CH3:1][C:2]([CH2:3][CH2:4][C:5](=[O:7])[N:35]1[CH2:34][CH2:33][N:32]([CH2:38][CH2:39][O:40][c:41]2[cH:42][c:43]([CH2:49][OH:50])[n:44][c:45]([CH2:47][OH:48])[cH:46]2)[CH2:37][CH2:36]1)([CH3:8])[S:9][S:10][CH3:11]
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 6

HCID 962WaterHCID 6228DimethylformamideHCID 12734DiisopropylcarbodiimideHCID 757711-HydroxybenzotriazoleHCID 115646344-Methyl-4-(methyldisulfanyl)pentanoic acidHCID 670322814-[2-(Piperazin-1-yl)ethoxy]-2,6-bis(hydroxymethyl)pyridine

Product 1

HCID 86671293
4-(2-[4-(4-Methyl-4-(methyldisulphanyl)pentanoyl)piperazin-1-yl]ethoxy)-2,6-bis(hydroxymethyl)pyridine

Sources & evidence

ORD record
ord-66351bdd31c44fd4811fde2eef812fac
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

Reaction notes

Loading…

On this pageParticipantsSources & evidenceReaction notes