Hydrochloric Acid → 6-chloro-5-methyl-1-[1-(tetrahydro-2H-pyran-4-yl)-4-piperidinyl]-1,3-dihydro-2H-benzimidazol-2-one

HRID 295186Notes

Reaction equation

[C:27]([BH3-:28])#[N:29].[CH3:31][OH:32].[Cl:2][c:3]1[c:4]([CH3:19])[cH:5][c:6]2[c:7]([n:8]([CH:12]3[CH2:13][CH2:14][NH:15][CH2:16][CH2:17]3)[c:9](=[O:11])[nH:10]2)[cH:18]1.[ClH:1].[Na+:30].[O:20]1[CH2:21][CH2:22][C:23](=[O:26])[CH2:24][CH2:25]1>>[Cl:2][c:3]1[c:4]([CH3:19])[cH:5][c:6]2[c:7]([n:8]([CH:12]3[CH2:13][CH2:14][N:15]([CH:23]4[CH2:22][CH2:21][O:20][CH2:25][CH2:24]4)[CH2:16][CH2:17]3)[c:9](=[O:11])[nH:10]2)[cH:18]1

Participants

Reactant 6

HCID 313Hydrochloric Acid

HCID 887Methanol

HCID 923Sodium ion

HCID 121599Tetrahydro-4H-pyran-4-one

HCID 498716Cyano-borohydride

HCID 598502036-chloro-5-methyl-1-(piperidin-4-yl)-1H-benzo[d]imidazol-2(3H)-one

Product 1

HCID 160710146-chloro-5-methyl-1-[1-(tetrahydro-2H-pyran-4-yl)-4-piperidinyl]-1,3-dihydro-2H-benzimidazol-2-one

Sources & evidence

ORD record: ord-aae6b5d5db774747b06ad8826a9538b7
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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