Dichloromethane → 4-[5-Aminomethyl-2-(3-vinyl-indazol-1-ylmethyl)-benzoimidazol-1-yl]-butan-1-ol

HRID 1216797Notes

Reaction equation

HRID 1216797 reaction equation
[C:1]([O:2][C:3](=[O:4])[NH:7][CH2:8][c:9]1[cH:10][c:11]2[c:12]([n:13]([CH2:28][CH2:29][CH2:30][CH2:31][OH:32])[c:14]([CH2:16][n:17]3[n:18][c:19]([CH:26]=[CH2:27])[c:20]4[cH:21][cH:22][cH:23][cH:24][c:25]34)[n:15]2)[cH:33][cH:34]1)([CH3:5])([CH3:6])[CH3:35].[Cl:43][CH2:44][Cl:45].[F:36][C:37]([F:38])([F:39])[C:40]([OH:41])=[O:42]>>[NH2:7][CH2:8][c:9]1[cH:10][c:11]2[c:12]([n:13]([CH2:28][CH2:29][CH2:30][CH2:31][OH:32])[c:14]([CH2:16][n:17]3[n:18][c:19]([CH:26]=[CH2:27])[c:20]4[cH:21][cH:22][cH:23][cH:24][c:25]34)[n:15]2)[cH:33][cH:34]1

Participants

4

Reactant 3

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 69719540[1-(4-hydroxy-butyl)-2-(3-vinyl-indazol-1-ylmethyl)-1H-benzoimidazol-5-ylmethyl]-carbamic acid tert-butyl ester

Product 1

HCID 223492944-[5-Aminomethyl-2-(3-vinyl-indazol-1-ylmethyl)-benzoimidazol-1-yl]-butan-1-ol

Sources & evidence

ORD record
ord-6557c53e65154caf8b45b319608be00d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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