Potassium Cation → [12-[(2,4-Difluorophenyl)methylcarbamoyl]-6-methyl-8,11-dioxo-4-oxa-1,7-diazatricyclo[7.4.0.03,7]trideca-9,12-dien-10-yl]oxymethyl propan-2-yl carbonate

HRID 1562390Notes

Reaction equation

HRID 1562390 reaction equation
[C:1]([O:2][CH2:3][I:4])([O:5][CH:6]([CH3:7])[CH3:8])=[O:9].[C:40](=[O:41])([O-:42])[O-:43].[CH2:51]([N+:52]([CH2:53][CH2:54][CH2:55][CH3:56])([CH2:57][CH2:58][CH2:59][CH3:60])[CH2:61][CH2:62][CH2:63][CH3:64])[CH2:65][CH2:66][CH3:67].[F:11][c:12]1[c:13]([CH2:19][NH:20][C:21](=[O:22])[c:23]2[c:24](=[O:39])[c:25]([OH:38])[c:26]3[n:27]([cH:37]2)[CH2:28][CH:29]2[N:30]([C:31]3=[O:32])[CH:33]([CH3:36])[CH2:34][O:35]2)[cH:14][cH:15][c:16]([F:18])[cH:17]1.[K+:44].[K+:45].[Na:10].[S:46]([O-:47])([OH:48])(=[O:49])=[O:50]>>[C:1]([O:2][CH2:3][O:38][c:25]1[c:24](=[O:39])[c:23]([C:21]([NH:20][CH2:19][c:13]2[c:12]([F:11])[cH:17][c:16]([F:18])[cH:15][cH:14]2)=[O:22])[cH:37][n:27]2[c:26]1[C:31](=[O:32])[N:30]1[CH:29]([CH2:28]2)[O:35][CH2:34][CH:33]1[CH3:36])([O:5][CH:6]([CH3:7])[CH3:8])=[O:9]

Participants

8

Reactant 7

HCID 813Potassium Cation2×HCID 16028TetrabutylammoniumHCID 19660Carbonate IonHCID 61778Sulfate, hydrogenHCID 5360545SodiumHCID 15870216Iodomethyl propan-2-yl carbonateHCID 66799609Oxazolo[3,2-a]pyrido[1,2-d]pyrazine-8-carboxamide, N-[(2,4-difluorophenyl)methyl]-2,3,5,7,11,11a-hexahydro-6-hydroxy-3-methyl-5,7-dioxo-, (3S,11aR)-;Oxazolo[3,2-a]pyrido[1,2-d]pyrazine-8-carboxamide, N-[(2,4-difluorophenyl)methyl]-2,3,5,7,11,11a-hexahydro-6-hydroxy-3-methyl-5,7-dioxo-, (3S,11aR)-

Product 1

HCID 75057908[12-[(2,4-Difluorophenyl)methylcarbamoyl]-6-methyl-8,11-dioxo-4-oxa-1,7-diazatricyclo[7.4.0.03,7]trideca-9,12-dien-10-yl]oxymethyl propan-2-yl carbonate

Sources & evidence

ORD record
ord-e29e1992e80e43d69e26b1def565a0e0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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