1-Bromo-4-chlorobutane → 1-{3-{Bis[4-(methoxymethoxy)phenyl]methyl}-1-(4-chlorobutyl)indol-2-ylcarbonyl}-4-(2-chlorophenyl)piperazine

HRID 199188Notes

Reaction equation

HRID 199188 reaction equation
[Br:46][CH2:47][CH2:48][CH2:49][CH2:50][Cl:51].[CH3:1][O:2][CH2:3][O:4][c:5]1[cH:6][cH:7][c:8]([CH:11]([c:12]2[c:13]([C:21](=[O:22])[N:23]3[CH2:24][CH2:25][N:26]([c:29]4[c:30]([Cl:35])[cH:31][cH:32][cH:33][cH:34]4)[CH2:27][CH2:28]3)[nH:14][c:15]3[cH:16][cH:17][cH:18][cH:19][c:20]23)[c:36]2[cH:37][cH:38][c:39]([O:42][CH2:43][O:44][CH3:45])[cH:40][cH:41]2)[cH:9][cH:10]1>>[CH3:1][O:2][CH2:3][O:4][c:5]1[cH:6][cH:7][c:8]([CH:11]([c:12]2[c:13]([C:21](=[O:22])[N:23]3[CH2:24][CH2:25][N:26]([c:29]4[c:30]([Cl:35])[cH:31][cH:32][cH:33][cH:34]4)[CH2:27][CH2:28]3)[n:14]([CH2:47][CH2:48][CH2:49][CH2:50][Cl:51])[c:15]3[cH:16][cH:17][cH:18][cH:19][c:20]23)[c:36]2[cH:37][cH:38][c:39]([O:42][CH2:43][O:44][CH3:45])[cH:40][cH:41]2)[cH:9][cH:10]1

Participants

3

Reactant 2

HCID 813641-Bromo-4-chlorobutaneHCID 158589011-{3-{Bis[4-(methoxymethoxy)phenyl]methyl}indol-2-ylcarbonyl}-4-(2-chlorophenyl)piperazine

Product 1

HCID 701441031-{3-{Bis[4-(methoxymethoxy)phenyl]methyl}-1-(4-chlorobutyl)indol-2-ylcarbonyl}-4-(2-chlorophenyl)piperazine

Sources & evidence

ORD record
ord-7ab579b69f0c41c7ab44df51a2e63a39
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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