4-(3-Amino-2-hydroxypropoxy)phenol → HCID 178527546, compound

HRID 686763Notes

Reaction equation

HRID 686763 reaction equation
[NH2:36][CH2:37][CH:38]([CH2:39][O:40][c:41]1[cH:42][cH:43][c:44]([OH:47])[cH:45][cH:46]1)[OH:48].[O:1]=[C:2]1[CH2:3][CH2:4][N:5]([c:8]2[cH:9][cH:10][c:11]([NH:14][S:15](=[O:16])(=[O:17])[c:18]3[s:19][c:20]([S:23](=[O:24])(=[O:25])[c:26]4[n:27][cH:28][c:29]([C:32]([F:33])([F:34])[F:35])[cH:30][cH:31]4)[cH:21][cH:22]3)[cH:12][cH:13]2)[CH2:6][CH2:7]1>>[CH:2]1([NH:36][CH2:37][CH:38]([CH2:39][O:40][c:41]2[cH:42][cH:43][c:44]([OH:47])[cH:45][cH:46]2)[OH:48])[CH2:3][CH2:4][N:5]([c:8]2[cH:9][cH:10][c:11]([NH:14][S:15](=[O:16])(=[O:17])[c:18]3[s:19][c:20]([S:23](=[O:24])(=[O:25])[c:26]4[n:27][cH:28][c:29]([C:32]([F:33])([F:34])[F:35])[cH:30][cH:31]4)[cH:21][cH:22]3)[cH:12][cH:13]2)[CH2:6][CH2:7]1

Participants

3

Reactant 2

HCID 222202294-(3-Amino-2-hydroxypropoxy)phenolHCID 865845715-(5-Trifluoromethyl-pyridin-2-sulfonyl)-thiophene-2-sulfonic acid [4-(4-oxo-piperidin-1-yl)-phenyl]-amide

Product 1

HCID 178527546HCID 178527546, compound

Sources & evidence

ORD record
ord-76e1e4d7e66240d78f03481b4b52f884
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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