1-[4-(3-Piperidin-1-yl-propoxy)-benzyl]-[1,4]diazepane → Phenyl[4-({4-[(piperidin-4-yl)oxy]phenyl}methyl)piperazin-1-yl]methanone

HRID 136854Notes

Reaction equation

HRID 136854 reaction equation
[C:1]([O:2][C:3](=[O:4])[N:8]1[CH2:9][CH2:10][CH:11]([O:14][c:15]2[cH:16][cH:17][c:18]([CH2:21][N:22]3[CH2:23][CH2:24][N:25]([C:28](=[O:29])[c:30]4[cH:31][cH:32][cH:33][cH:34][cH:35]4)[CH2:26][CH2:27]3)[cH:19][cH:20]2)[CH2:12][CH2:13]1)([CH3:5])([CH3:6])[CH3:7].[N:36]1([CH2:37][CH2:38][CH2:39][O:40][c:41]2[cH:42][cH:43][c:44]([CH2:45][N:46]3[CH2:47][CH2:48][CH2:49][NH:50][CH2:51][CH2:52]3)[cH:53][cH:54]2)[CH2:55][CH2:56][CH2:57][CH2:58][CH2:59]1>>[NH:8]1[CH2:9][CH2:10][CH:11]([O:14][c:15]2[cH:16][cH:17][c:18]([CH2:21][N:22]3[CH2:23][CH2:24][N:25]([C:28](=[O:29])[c:30]4[cH:31][cH:32][cH:33][cH:34][cH:35]4)[CH2:26][CH2:27]3)[cH:19][cH:20]2)[CH2:12][CH2:13]1

Participants

3

Reactant 2

HCID 596405921-[4-(3-Piperidin-1-yl-propoxy)-benzyl]-[1,4]diazepaneHCID 687021234-{4-[4-(1-Phenyl-methanoyl)-piperazin-1-ylmethyl]-phenoxy}-piperidine-1-carboxylic acid tert-butyl ester

Product 1

HCID 57935703Phenyl[4-({4-[(piperidin-4-yl)oxy]phenyl}methyl)piperazin-1-yl]methanone

Sources & evidence

ORD record
ord-aad70ae5c9124b8d8518c350432f4eab
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

Loading…