Hydrochloric Acid → Benzyl 4-[2-(4-hydroxybenzenesulfonylamino)-1-methoxycarbonylethyl]piperazine-1-carboxylate

HRID 188943Notes

Reaction equation

HRID 188943 reaction equation
[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[Cl:45][CH2:46][Cl:47].[ClH:19].[ClH:20].[NH2:21][CH2:22][CH:23]([C:24](=[O:25])[O:26][CH3:27])[N:28]1[CH2:29][CH2:30][N:31]([C:34](=[O:35])[O:36][CH2:37][c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)[CH2:32][CH2:33]1.[OH2:44].[OH:8][c:9]1[cH:10][cH:11][c:12]([S:15](=[O:16])(=[O:17])[Cl:18])[cH:13][cH:14]1>>[OH:8][c:9]1[cH:10][cH:11][c:12]([S:15](=[O:16])(=[O:17])[NH:21][CH2:22][CH:23]([C:24](=[O:25])[O:26][CH3:27])[N:28]2[CH2:29][CH2:30][N:31]([C:34](=[O:35])[O:36][CH2:37][c:38]3[cH:39][cH:40][cH:41][cH:42][cH:43]3)[CH2:32][CH2:33]2)[cH:13][cH:14]1

Participants

7

Reactant 6

HCID 313Hydrochloric Acid2×HCID 962WaterHCID 6344DichloromethaneHCID 8471TriethylamineHCID 114240934-Hydroxybenzene-1-sulfonyl chlorideHCID 86675019Benzyl 4-(3-amino-1-methoxy-1-oxopropan-2-yl)piperazine-1-carboxylate

Product 1

HCID 71115508Benzyl 4-[2-(4-hydroxybenzenesulfonylamino)-1-methoxycarbonylethyl]piperazine-1-carboxylate

Sources & evidence

ORD record
ord-598ba12a7ca44604a2d4eb860a183d5d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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