Piperidine → 1,3-dimethyl-10-(2-piperidin-1-ylacetyl)-5H-pyrazolo[5,4-c][1,5]benzodiazepin-4-one

HRID 99239Notes

Reaction equation

HRID 99239 reaction equation
[CH2:22]1[CH2:23][CH2:24][NH:25][CH2:26][CH2:27]1.[Cl:1][CH2:2][C:3](=[O:4])[N:5]1[c:6]2[c:7]([n:17]([CH3:21])[n:18][c:19]2[CH3:20])[C:8](=[O:16])[NH:9][c:10]2[c:11]1[cH:12][cH:13][cH:14][cH:15]2.[O:28]1[CH2:29][CH2:30][O:31][CH2:32][CH2:33]1>>[CH2:2]([C:3](=[O:4])[N:5]1[c:6]2[c:7]([n:17]([CH3:21])[n:18][c:19]2[CH3:20])[C:8](=[O:16])[NH:9][c:10]2[c:11]1[cH:12][cH:13][cH:14][cH:15]2)[N:25]1[CH2:24][CH2:23][CH2:22][CH2:27][CH2:26]1

Participants

4

Reactant 3

HCID 8082PiperidineHCID 312751,4-DioxaneHCID 205498784-Chloroacetyl-1,3-dimethyl-1,4,9,10-tetrahydropyrazolo[4,3-b][1,5]benzodiazepin-10-one

Product 1

HCID 205498861,3-dimethyl-10-(2-piperidin-1-ylacetyl)-5H-pyrazolo[5,4-c][1,5]benzodiazepin-4-one

Sources & evidence

ORD record
ord-03a8889cbe7747ab91efa9bb1adc6c2d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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