1,2-Dichloroethane → Gsk 1034702

HRID 1537633Notes

Reaction equation

HRID 1537633 reaction equation
[C:34]([O:35][BH-:36]([O:37][C:38](=[O:39])[CH3:40])[O:41][C:42](=[O:43])[CH3:44])(=[O:45])[CH3:46].[CH3:20][CH2:21][N:22]([CH2:23][CH3:24])[CH2:25][CH3:26].[Cl:48][CH2:49][Cl:50].[Cl:51][CH2:52][CH2:53][Cl:54].[ClH:1].[F:2][c:3]1[cH:4][c:5]([CH3:19])[cH:6][c:7]2[n:8]([CH:13]3[CH2:14][CH2:15][NH:16][CH2:17][CH2:18]3)[c:9](=[O:12])[nH:10][c:11]12.[Na+:47].[O:27]1[CH2:28][CH2:29][C:30](=[O:33])[CH2:31][CH2:32]1>>[F:2][c:3]1[cH:4][c:5]([CH3:19])[cH:6][c:7]2[n:8]([CH:13]3[CH2:14][CH2:15][N:16]([CH:30]4[CH2:29][CH2:28][O:27][CH2:32][CH2:31]4)[CH2:17][CH2:18]3)[c:9](=[O:12])[nH:10][c:11]12

Participants

9

Reactant 8

HCID 111,2-DichloroethaneHCID 313Hydrochloric AcidHCID 923Sodium ionHCID 6344DichloromethaneHCID 8471TriethylamineHCID 121599Tetrahydro-4H-pyran-4-oneHCID 2724942TriacetoxyborohydrideHCID 596832644-Fluoro-6-methyl-1-(4-piperidinyl)-1,3-dihydro-2H-benzimidazol-2-one

Product 1

HCID 16038386Gsk 1034702

Sources & evidence

ORD record
ord-16e8f25d8bad40f186b63aa2b68985ff
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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