Acetic Acid → 3-benzyl-9-(4-chlorophenyl)-8-(2,4-dichlorophenyl)-2,4,6-trimethyl-4,6-dihydropyrimido[5,4-c]-1,8-naphthyridin-5(3H)-one

HRID 173996Notes

Reaction equation

HRID 173996 reaction equation
[C:1]([CH3:2])([c:4]1[c:5](=[O:34])[n:6]([CH3:33])[c:7]2[n:8][c:9](-[c:25]3[c:26]([Cl:32])[cH:27][c:28]([Cl:31])[cH:29][cH:30]3)[c:10](-[c:18]3[cH:19][cH:20][c:21]([Cl:24])[cH:22][cH:23]3)[cH:11][c:12]2[c:13]1[NH:14][C:15](=[O:3])[CH3:16])=[O:17].[C:43]([O:44][BH-:45]([O:46][C:47](=[O:48])[CH3:49])[O:50][C:51](=[O:52])[CH3:53])(=[O:54])[CH3:55].[CH2:35]([c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1)[NH2:42].[CH3:57][C:58](=[O:59])[OH:60].[Cl:61][CH2:62][Cl:63].[Na+:56]>>[CH:1]1([CH3:2])[c:4]2[c:5](=[O:34])[n:6]([CH3:33])[c:7]3[n:8][c:9](-[c:25]4[c:26]([Cl:32])[cH:27][c:28]([Cl:31])[cH:29][cH:30]4)[c:10](-[c:18]4[cH:19][cH:20][c:21]([Cl:24])[cH:22][cH:23]4)[cH:11][c:12]3[c:13]2[N:14]=[C:15]([CH3:16])[N:42]1[CH2:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 923Sodium ionHCID 6344DichloromethaneHCID 7504BenzylamineHCID 2724942TriacetoxyborohydrideHCID 11386747Naphthyridinone

Product 1

HCID 588101233-benzyl-9-(4-chlorophenyl)-8-(2,4-dichlorophenyl)-2,4,6-trimethyl-4,6-dihydropyrimido[5,4-c]-1,8-naphthyridin-5(3H)-one

Sources & evidence

ORD record
ord-a831d9c08c1d49eba006e94efbade562
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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