Hydrochloric Acid → 4-[4,4-bis(4-fluorophenyl)butyl]-N-(2-hydroxyethyl)-2-piperazinecarboxamide

反応式

[ClH:34].[F:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([CH2:9][CH2:10][CH2:11][N:12]2[CH2:13][CH:14]3[N:15]([CH2:16][CH2:17]2)[C:18]([CH3:25])([CH3:26])[N:19]([CH2:22][CH2:23][OH:24])[C:20]3=[O:21])[c:27]2[cH:28][cH:29][c:30]([F:33])[cH:31][cH:32]2)[cH:6][cH:7]1.[OH2:35]>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([CH2:9][CH2:10][CH2:11][N:12]2[CH2:13][CH:14]([C:20]([NH:19][CH2:22][CH2:23][OH:24])=[O:21])[NH:15][CH2:16][CH2:17]2)[c:27]2[cH:28][cH:29][c:30]([F:33])[cH:31][cH:32]2)[cH:6][cH:7]1

参加物

反応物 3

HCID 313Hydrochloric Acid

HCID 962Water

HCID 212956477-[4,4-bis(4-fluorophenyl)butyl]hexahydro-2-(2-hydroxyethyl)-3,3-dimethylimidazo[1,5-a]pyrazin-1(5H)-one

生成物 1

HCID 212956904-[4,4-bis(4-fluorophenyl)butyl]-N-(2-hydroxyethyl)-2-piperazinecarboxamide

出典と根拠

ORDレコード: ord-985e36acafc24c14b6d601964fc725ea
出典データセット: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

反応ノート

読み込み中…