2,4-Di-tert-butyl-6-piperazin-1-ylpyrimidine → Hydrochloric Acid

HRID 178158Notes

Reaction equation

HRID 178158 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][c:7]([N:15]2[CH2:16][CH2:17][NH:18][CH2:19][CH2:20]2)[cH:8][c:9]([C:11]([CH3:12])([CH3:13])[CH3:14])[n:10]1.[Cl:21][CH2:22][CH2:23][CH2:24][CH2:25][N:26]1[C:27](=[O:38])[CH2:28][CH2:29][C:30](=[O:37])[c:31]2[c:32]1[cH:33][cH:34][cH:35][cH:36]2>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][c:7]([N:15]2[CH2:16][CH2:17][N:18]([CH2:22][CH2:23][CH2:24][CH2:25][N:26]3[C:27](=[O:38])[CH2:28][CH2:29][C:30](=[O:37])[c:31]4[c:32]3[cH:33][cH:34][cH:35][cH:36]4)[CH2:19][CH2:20]2)[cH:8][c:9]([C:11]([CH3:12])([CH3:13])[CH3:14])[n:10]1.[ClH:21]

Participants

4

Reactant 2

HCID 114600842,4-Di-tert-butyl-6-piperazin-1-ylpyrimidineHCID 685828961-(4-chlorobutyl)-3,4-dihydro-1H-benzo[b]azepine-2,5-dione

Product 2

HCID 313Hydrochloric AcidHCID 685831521-[4-[4-(2,6-Ditert-butylpyrimidin-4-yl)piperazin-1-yl]butyl]-3,4-dihydro-1-benzazepine-2,5-dione

Sources & evidence

ORD record
ord-ff1bc1bc9402416780e3222a29bac082
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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