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Methanol → 5,6-dimethyl-1-[1-(tetrahydro-2H-pyran-4-yl)-4-piperidinyl]-1,3-dihydro-2H-benzimidazol-2-one

HRID 92128
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인쇄 미리보기

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HRID 92128 반응식
[BH4-:47].[C:33]([O:34][BH-:35]([O:36][C:37](=[O:38])[CH3:39])[O:40][C:41](=[O:42])[CH3:43])(=[O:44])[CH3:45].[C:48]([BH3-:49])#[N:50].[CH3:19][CH2:20][N:21]([CH2:22][CH3:23])[CH2:24][CH3:25].[CH3:1][c:2]1[cH:3][c:4]2[c:5]([n:6]([CH:10]3[CH2:11][CH2:12][NH:13][CH2:14][CH2:15]3)[c:7](=[O:9])[nH:8]2)[cH:16][c:17]1[CH3:18].[CH3:55][OH:56].[Cl:52][CH2:53][Cl:54].[Na+:46].[Na+:51].[O:26]1[CH2:27][CH2:28][C:29](=[O:32])[CH2:30][CH2:31]1>>[CH3:1][c:2]1[cH:3][c:4]2[c:5]([n:6]([CH:10]3[CH2:11][CH2:12][N:13]([CH:29]4[CH2:28][CH2:27][O:26][CH2:31][CH2:30]4)[CH2:14][CH2:15]3)[c:7](=[O:9])[nH:8]2)[cH:16][c:17]1[CH3:18]
참가 물질출처 및 근거반응 노트

참가 물질

10

반응물 9

HCID 887MethanolHCID 923Sodium Ion2회HCID 6344DichloromethaneHCID 8471TriethylamineHCID 28123BorohydrideHCID 121599Tetrahydro-4H-pyran-4-oneHCID 498716Cyano-borohydrideHCID 2724942
Triacetoxyborohydride
HCID 204466955,6-dimethyl-1-(piperidin-4-yl)-1H-benzo[d]imidazol-2(3H)-one

생성물 1

HCID 160710195,6-dimethyl-1-[1-(tetrahydro-2H-pyran-4-yl)-4-piperidinyl]-1,3-dihydro-2H-benzimidazol-2-one

출처 및 근거

ORD 기록
ord-00b382c64d354de8bbbef3f045769af2
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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