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

Methanol → N-[4-[N-[3-(4-chlorophenyl)-3-(2-pyridyl)propyl]-N-methylamino]butyl]-N'-[3-[3-(piperidinomethyl)phenoxy]propyl]urea

HRID 680662
Notes
Print preview

Reaction equation

HRID 680662 reaction equation
[C:24](=[O:25])([n:26]1[cH:27][cH:28][n:29][cH:30]1)[n:31]1[cH:32][cH:33][n:34][cH:35]1.[C:56]([O:57][CH2:58][CH3:59])(=[O:60])[CH3:61].[CH3:54][OH:55].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([CH2:9][CH2:10][N:11]([CH2:12][CH2:13][CH2:14][CH2:15][NH2:16])[CH3:17])[c:18]2[n:19][cH:20][cH:21][cH:22][cH:23]2)[cH:6][cH:7]1.[N:36]1([CH2:42][c:43]2[cH:44][c:45]([O:46][CH2:47][CH2:48][CH2:49][NH2:50])[cH:51][cH:52][cH:53]2)[CH2:37][CH2:38][CH2:39][CH2:40][CH2:41]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([CH2:9][CH2:10][N:11]([CH2:12][CH2:13][CH2:14][CH2:15][NH:16][C:24](=[O:25])[NH:50][CH2:49][CH2:48][CH2:47][O:46][c:45]2[cH:44][c:43]([CH2:42][N:36]3[CH2:37][CH2:38][CH2:39][CH2:40][CH2:41]3)[cH:53][cH:52][cH:51]2)[CH3:17])[c:18]2[n:19][cH:20][cH:21][cH:22][cH:23]2)[cH:6][cH:7]1
ParticipantsSources & evidenceReaction notes

Participants

6

Reactant 5

HCID 887MethanolHCID 8857Ethyl AcetateHCID 682631,1'-CarbonyldiimidazoleHCID 102205613-(3-(Piperidin-1-ylmethyl)phenoxy)propan-1-amineHCID 19762494N-[3-(4-chlorophenyl)-3-(2-pyridyl)propyl]-N-methyl-1,4-butanediamine

Product 1

HCID 19762572
N-[4-[N-[3-(4-chlorophenyl)-3-(2-pyridyl)propyl]-N-methylamino]butyl]-N'-[3-[3-(piperidinomethyl)phenoxy]propyl]urea

Sources & evidence

ORD record
ord-d67efd57ba244e0b95a68443053e21fe
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

Reaction notes

Loading…

On this pageParticipantsSources & evidenceReaction notes