Hydrochloric Acid → 4-[4-(3,4-dihydro-2H-quinoxalin-1-yl)phenyl]piperazine-1-carboxylic acid benzyl ester

HRID 208032Notes

Reaction equation

HRID 208032 reaction equation
[C:1]([O:2][C:3](=[O:4])[N:8]1[CH2:9][CH2:10][N:11]([c:18]2[cH:19][cH:20][c:21]([N:24]3[CH2:25][CH2:26][N:27]([C:30](=[O:31])[O:32][CH2:33][c:34]4[cH:35][cH:36][cH:37][cH:38][cH:39]4)[CH2:28][CH2:29]3)[cH:22][cH:23]2)[c:12]2[cH:13][cH:14][cH:15][cH:16][c:17]21)([CH3:5])([CH3:6])[CH3:7].[Cl:47][CH2:48][Cl:49].[ClH:40].[Na+:41].[Na+:42].[O-:43][C:44](=[O:45])[O-:46].[O:50]1[CH2:51][CH2:52][O:53][CH2:54][CH2:55]1>>[NH:8]1[CH2:9][CH2:10][N:11]([c:18]2[cH:19][cH:20][c:21]([N:24]3[CH2:25][CH2:26][N:27]([C:30](=[O:31])[O:32][CH2:33][c:34]4[cH:35][cH:36][cH:37][cH:38][cH:39]4)[CH2:28][CH2:29]3)[cH:22][cH:23]2)[c:12]2[cH:13][cH:14][cH:15][cH:16][c:17]21

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 923Sodium ion2×HCID 6344DichloromethaneHCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 668635804-[4-(4-(Benzyloxycarbonyl)piperazin-1-yl)phenyl]-3,4-dihydro-2H-quinoxaline-1-carboxylic acid tert-butyl ester

Product 1

HCID 668632134-[4-(3,4-dihydro-2H-quinoxalin-1-yl)phenyl]piperazine-1-carboxylic acid benzyl ester

Sources & evidence

ORD record
ord-7a29fe68709443ae8b3224190e137900
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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