Hydrochloric Acid → HCID 69980313, compound

HRID 2310094Notes

Reaction equation

HRID 2310094 reaction equation
[CH:24]1([N:25]=[C:26]=[N:27][CH:28]2[CH2:29][CH2:30][CH2:31][CH2:32][CH2:33]2)[CH2:34][CH2:35][CH2:36][CH2:37][CH2:38]1.[CH:39]([N:40]([CH2:41][CH3:42])[CH:43]([CH3:44])[CH3:45])([CH3:46])[CH3:47].[Cl:76][CH2:77][Cl:78].[ClH:48].[ClH:49].[N:50]1([c:56]2[c:57]([F:75])[cH:58][c:59]([N:62]3[C:63](=[O:74])[O:64][CH:65]([CH2:67][O:68][c:69]4[n:70][o:71][cH:72][cH:73]4)[CH2:66]3)[cH:60][cH:61]2)[CH2:51][CH2:52][NH:53][CH2:54][CH2:55]1.[OH:16][N:17]1[C:18](=[O:19])[CH2:20][CH2:21][C:22]1=[O:23].[c:1]1([CH:7]2[O:8][CH2:9][CH:10]([C:13](=[O:14])[OH:15])[CH2:11][O:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]2[O:8][CH2:9][CH:10]([C:13](=[O:15])[N:53]3[CH2:52][CH2:51][N:50]([c:56]4[c:57]([F:75])[cH:58][c:59]([N:62]5[C:63](=[O:74])[O:64][CH:65]([CH2:67][O:68][c:69]6[n:70][o:71][cH:72][cH:73]6)[CH2:66]5)[cH:60][cH:61]4)[CH2:55][CH2:54]3)[CH2:11][O:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

8

Reactant 7

HCID 313Hydrochloric Acid2×HCID 6344DichloromethaneHCID 10868DicyclohexylcarbodiimideHCID 80170N-HydroxysuccinimideHCID 81531DiisopropylethylamineHCID 105844682-phenyl-1,3-dioxane-5-carboxylic AcidHCID 571103703-(3-Fluoro-4-piperazin-1-ylphenyl)-5-(1,2-oxazol-3-yloxymethyl)-1,3-oxazolidin-2-one

Product 1

HCID 69980313HCID 69980313, compound

Sources & evidence

ORD record
ord-0e5342baa3a7479b8a0fd33ab18d6ff1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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