Ammonia → Methyl 4'-({[(1-{[amino(oxo)acetyl]amino}cyclopropyl)carbonyl]amino}methyl)-3,3'-difluoro-1,1'-biphenyl-2-carboxylate

HRID 1550298Notes

Reaction equation

HRID 1550298 reaction equation
[CH2:34]([Cl:35])[Cl:36].[CH3:37][OH:38].[F:1][c:2]1[c:3]([C:29](=[O:30])[O:31][CH3:32])[c:4](-[c:8]2[cH:9][c:10]([F:28])[c:11]([CH2:14][NH:15][C:16](=[O:17])[C:18]3([NH:21][C:22]([C:23]([O:25][CH3:24])=[O:26])=[O:27])[CH2:19][CH2:20]3)[cH:12][cH:13]2)[cH:5][cH:6][cH:7]1.[NH3:33]>>[F:1][c:2]1[c:3]([C:29](=[O:30])[O:31][CH3:32])[c:4](-[c:8]2[cH:9][c:10]([F:28])[c:11]([CH2:14][NH:15][C:16](=[O:17])[C:18]3([NH:21][C:22]([C:23](=[O:25])[NH2:33])=[O:27])[CH2:19][CH2:20]3)[cH:12][cH:13]2)[cH:5][cH:6][cH:7]1

Participants

5

Reactant 4

HCID 222AmmoniaHCID 887MethanolHCID 6344DichloromethaneHCID 21988941Methyl 3,3'-difluoro-4'-({[(1-{[methoxy(oxo)acetyl]amino}cyclopropyl)-carbonyl]amino}methyl)-1,1'-biphenyl-2-carboxylate

Product 1

HCID 21988956Methyl 4'-({[(1-{[amino(oxo)acetyl]amino}cyclopropyl)carbonyl]amino}methyl)-3,3'-difluoro-1,1'-biphenyl-2-carboxylate

Sources & evidence

ORD record
ord-1cce26c7402249cf8247abdb16ffac2a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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