Hydrogen Bromide → Methyl 2-[(4-tert-Butylpiperazin-1-ylcarbonyl)amino]benzoate

HRID 959923Notes

Reaction equation

HRID 959923 reaction equation
[BrH:14].[BrH:15].[C:16]([CH3:17])([CH3:18])([CH3:19])[N:20]1[CH2:21][CH2:22][NH:23][CH2:24][CH2:25]1.[CH3:38][N:39]([CH3:40])[CH:41]=[O:42].[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[CH:26]([N:27]([CH2:28][CH3:29])[CH:30]([CH3:31])[CH3:32])([CH3:33])[CH3:34].[Cl:35][CH2:36][Cl:37].[N:1](=[C:2]=[O:3])[c:4]1[c:5]([C:6](=[O:7])[O:8][CH3:9])[cH:10][cH:11][cH:12][cH:13]1>>[NH:1]([C:2](=[O:3])[N:23]1[CH2:22][CH2:21][N:20]([C:16]([CH3:17])([CH3:18])[CH3:19])[CH2:25][CH2:24]1)[c:4]1[c:5]([C:6](=[O:7])[O:8][CH3:9])[cH:10][cH:11][cH:12][cH:13]1

Participants

8

Reactant 7

HCID 260Hydrogen Bromide2×HCID 6228DimethylformamideHCID 6344DichloromethaneHCID 8857Ethyl AcetateHCID 81531DiisopropylethylamineHCID 519494Methyl 2-isocyanatobenzoateHCID 35305721-Tert-butylpiperazine

Product 1

HCID 21906314Methyl 2-[(4-tert-Butylpiperazin-1-ylcarbonyl)amino]benzoate

Sources & evidence

ORD record
ord-7384e10dc95744ca94876dc0341e2f24
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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