Chloride → 5-Chloro-7-(2,4-dichlorophenyl)-2-(1-methylpiperidin-4-yl)[1,2,4]triazolo[1,5-c]pyrimidine

HRID 1141242Notes

Reaction equation

HRID 1141242 reaction equation
[C:26](=[O:27])([OH:28])[O-:29].[CH2:37]([N+:38]([CH2:39][CH3:40])([CH2:41][CH3:42])[CH2:43][CH3:44])[c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1.[Cl-:36].[Cl:1][c:2]1[c:3](-[c:9]2[cH:10][c:11]3[n:12]([c:13](=[O:15])[nH:14]2)[n:16][c:17]([CH:19]2[CH2:20][CH2:21][N:22]([CH3:25])[CH2:23][CH2:24]2)[n:18]3)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1.[Na+:30].[P:31]([Cl:32])([Cl:33])([Cl:34])=[O:35]>>[Cl:1][c:2]1[c:3](-[c:9]2[cH:10][c:11]3[n:12]([c:13]([Cl:33])[n:14]2)[n:16][c:17]([CH:19]2[CH2:20][CH2:21][N:22]([CH3:25])[CH2:23][CH2:24]2)[n:18]3)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1

Participants

7

Reactant 6

HCID 312ChlorideHCID 769Bicarbonate IonHCID 923Sodium ionHCID 17208BenzyltriethylammoniumHCID 24813Phosphorus oxychlorideHCID 136104190HCID 136104190, compound

Product 1

HCID 583059825-Chloro-7-(2,4-dichlorophenyl)-2-(1-methylpiperidin-4-yl)[1,2,4]triazolo[1,5-c]pyrimidine

Sources & evidence

ORD record
ord-5e924ab3d83247a9bcc2f9c90c5f7bbd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

Loading…