Methanol → 3-[2-Methyl-4-(3-methyl-4,10-dihydro-3H-2,3,4,9-tetraaza-benzo[f]azulene-9-carbonyl)-phenyl]-propionic Acid Tert-butyl Ester

HRID 312294Notes

Reaction equation

HRID 312294 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH:7]=[CH:8][c:9]1[c:10]([CH3:32])[cH:11][c:12]([C:15](=[O:16])[N:17]2[c:18]3[c:19]([cH:28][cH:29][cH:30][cH:31]3)[NH:20][c:21]3[n:22]([CH3:27])[n:23][cH:24][c:25]3[CH2:26]2)[cH:13][cH:14]1)=[O:33].[CH3:34][OH:35]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][CH2:8][c:9]1[c:10]([CH3:32])[cH:11][c:12]([C:15](=[O:16])[N:17]2[c:18]3[c:19]([cH:28][cH:29][cH:30][cH:31]3)[NH:20][c:21]3[n:22]([CH3:27])[n:23][cH:24][c:25]3[CH2:26]2)[cH:13][cH:14]1)=[O:33]

Participants

3

Reactant 2

HCID 887MethanolHCID 136647571Tert-butyl 3-[2-methyl-4-(1-methyl-4,10-dihydropyrazolo[4,5-c][1,5]benzodiazepine-5-carbonyl)phenyl]prop-2-enoate

Product 1

HCID 1361283503-[2-Methyl-4-(3-methyl-4,10-dihydro-3H-2,3,4,9-tetraaza-benzo[f]azulene-9-carbonyl)-phenyl]-propionic Acid Tert-butyl Ester

Sources & evidence

ORD record
ord-65bbd85be5ca4fde9f65e261b36b6816
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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