Acetic Acid → {4-(Benzylamino-methyl)-phenyl}-{4-(1-ethyl-propyl)-piperazin-1-yl}-methanone

HRID 92438Notes

Reaction equation

HRID 92438 reaction equation
[C:30]([O:31][BH-:32]([O:33][C:34](=[O:35])[CH3:36])[O:37][C:38](=[O:39])[CH3:40])(=[O:41])[CH3:42].[CH2:1]([CH3:2])[CH:3]([CH2:4][CH3:5])[N:6]1[CH2:7][CH2:8][N:9]([C:12](=[O:13])[c:14]2[cH:15][cH:16][c:17]([CH:18]=[O:19])[cH:20][cH:21]2)[CH2:10][CH2:11]1.[CH3:49][C:50](=[O:51])[OH:52].[Cl:46][CH2:47][Cl:48].[NH2:22][CH2:23][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1.[Na+:43].[Na+:45].[OH-:44]>>[CH2:1]([CH3:2])[CH:3]([CH2:4][CH3:5])[N:6]1[CH2:7][CH2:8][N:9]([C:12](=[O:13])[c:14]2[cH:15][cH:16][c:17]([CH2:18][NH:22][CH2:23][c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)[cH:20][cH:21]2)[CH2:10][CH2:11]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 923Sodium ion2×HCID 961HydroxideHCID 6344DichloromethaneHCID 7504BenzylamineHCID 2724942TriacetoxyborohydrideHCID 57478578HCID 57478578, compound

Product 1

HCID 10022641{4-(Benzylamino-methyl)-phenyl}-{4-(1-ethyl-propyl)-piperazin-1-yl}-methanone

Sources & evidence

ORD record
ord-723ab9ae9ce4467db2b6f23f5c39f958
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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