Hydride → 7-chloro-5-(2-chlorophenyl)-8-methoxy-3-methyl-1,2-dihydropyrazolo[3,4-b][1,4]benzodiazepine

HRID 1233266Notes

Reaction equation

HRID 1233266 reaction equation
[CH2:60]([Al+:61][CH2:62][CH:63]([CH3:64])[CH3:65])[CH:66]([CH3:67])[CH3:68].[Cl:31][c:32]1[c:33]([O:57][CH3:58])[cH:34][c:35]2[c:36]([cH:56]1)[C:37]([c:49]1[c:50]([Cl:55])[cH:51][cH:52][cH:53][cH:54]1)=[N:38][C:39]1=[C:44]([CH3:45])[NH:43][N:42]([CH2:46][CH:47]=[CH2:48])[C:40]1=[N:41]2.[H-:59].[NH2:1][c:2]1[cH:3][c:4]([O:5][CH3:6])[c:7]([Cl:8])[cH:9][c:10]1[C:11]([c:12]1[cH:13][cH:14][cH:15][cH:16][c:17]1[Cl:18])=[O:19].[NH2:20][c:21]1[c:22]([CH3:23])[n:24][n:25]([CH2:26][CH:27]=[CH2:28])[c:29]1[Cl:30]>>[Cl:31][c:32]1[c:33]([O:57][CH3:58])[cH:34][c:35]2[c:36]([cH:56]1)[C:37]([c:49]1[c:50]([Cl:55])[cH:51][cH:52][cH:53][cH:54]1)=[N:38][C:39]1=[C:44]([CH3:45])[NH:43][NH:42][C:40]1=[N:41]2

Participants

6

Reactant 5

HCID 166653HydrideHCID 16686348Bis(2-methylpropyl)alumanyliumHCID 576423441-Allyl-5-chloro-3-methyl-1H-pyrazol-4-amineHCID 57642381(2-Amino-5-chloro-4-methoxyphenyl)-(2-chlorophenyl)-methanoneHCID 1784566427-chloro-5-(2-chlorophenyl)-8-methoxy-3-methyl-1-prop-2-enyl-2H-pyrazolo[3,4-b][1,4]benzodiazepine

Product 1

HCID 1784864227-chloro-5-(2-chlorophenyl)-8-methoxy-3-methyl-1,2-dihydropyrazolo[3,4-b][1,4]benzodiazepine

Sources & evidence

ORD record
ord-ddcb37418c5f451d8d9f0e9e5c9c2e34
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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