Hydrochloric Acid → 5-(2-chlorophenyl)-1-(2,6-dichlorophenyl)-7-(hydroxymethyl)-3,4-dihydroquinazolin-2(1H)-one

HRID 1205525Notes

Reaction equation

HRID 1205525 reaction equation
[Al+3:32].[CH2:44]1[O:45][CH2:46][CH2:47][CH2:48]1.[CH3:38][CH2:39][O:40][C:41](=[O:42])[CH3:43].[Cl:1][c:2]1[c:3](-[c:8]2[c:9]3[c:14]([cH:15][c:16]([C:18](=[O:19])[O:20][CH3:21])[cH:17]2)[N:13]([c:22]2[c:23]([Cl:29])[cH:24][cH:25][cH:26][c:27]2[Cl:28])[C:12](=[O:30])[NH:11][CH2:10]3)[cH:4][cH:5][cH:6][cH:7]1.[ClH:37].[H-:31].[H-:34].[H-:35].[H-:36].[Li+:33]>>[Cl:1][c:2]1[c:3](-[c:8]2[c:9]3[c:14]([cH:15][c:16]([CH2:18][OH:19])[cH:17]2)[N:13]([c:22]2[c:23]([Cl:29])[cH:24][cH:25][cH:26][c:27]2[Cl:28])[C:12](=[O:30])[NH:11][CH2:10]3)[cH:4][cH:5][cH:6][cH:7]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 28486Lithium ionHCID 104727Aluminum CationHCID 166653Hydride4×HCID 22648138Methyl 5-(2-chlorophenyl)-1-(2,6-dichlorophenyl)-2-oxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate

Product 1

HCID 226479725-(2-chlorophenyl)-1-(2,6-dichlorophenyl)-7-(hydroxymethyl)-3,4-dihydroquinazolin-2(1H)-one

Sources & evidence

ORD record
ord-f156546819d5458586fb287b60e37a1b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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