Chloride → HCID 67055979, compound

HRID 1119856Notes

Reaction equation

HRID 1119856 reaction equation
[C:45](=[O:46])([O-:47])[O-:48].[CH2:55]1[O:56][CH2:57][CH2:58][O:59][CH2:60]1.[CH3:26][C:27]1([CH3:28])[C:29]([CH3:30])([CH3:31])[O:32][B:33]([c:34]2[cH:35][c:36]([CH:40]([C:41]#[N:42])[CH3:43])[cH:37][n:38][cH:39]2)[O:44]1.[Cl-:54].[Cl:1][c:2]1[n:3][c:4]2[cH:5][cH:6][cH:7][c:8](-[c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[c:9]2[c:10]([NH:12][CH2:13][c:14]2[n:15][cH:16][cH:17][cH:18][cH:19]2)[n:11]1.[Cl:51][CH2:52][Cl:53].[K+:49].[K+:50].[OH2:61]>>[c:2]1(-[c:34]2[cH:35][c:36]([CH:40]([C:41]#[N:42])[CH3:43])[cH:37][n:38][cH:39]2)[n:3][c:4]2[cH:5][cH:6][cH:7][c:8](-[c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[c:9]2[c:10]([NH:12][CH2:13][c:14]2[n:15][cH:16][cH:17][cH:18][cH:19]2)[n:11]1

Participants

9

Reactant 8

HCID 312ChlorideHCID 813Potassium Cation2×HCID 962WaterHCID 6344DichloromethaneHCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 67055991HCID 67055991, compoundHCID 866706132-chloro-5-phenyl-N-(pyridin-2-ylmethyl)quinazolin-4-amine

Product 1

HCID 67055979HCID 67055979, compound

Sources & evidence

ORD record
ord-c194f9572f7e4effb9a3bbc7cb770e5e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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