Dichloromethane → 4-((3,5-Dimethyl-pyridin-2-ylmethyl)-{3-[1-(4-fluoro-phenyl)-1-methyl-ethyl]-pyridin-2-ylmethyl}-amino)-piperidine-1-carboxylic acid tert-butyl ester

HRID 171739

반응식

HRID 171739 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([NH:14][CH2:15][c:16]2[n:17][cH:18][cH:19][cH:20][c:21]2[C:22]([CH3:23])([CH3:24])[c:25]2[cH:26][cH:27][c:28]([F:31])[cH:29][cH:30]2)[CH2:12][CH2:13]1.[CH3:32][c:33]1[c:34]([CH:40]=[O:41])[n:35][cH:36][c:37]([CH3:39])[cH:38]1.[Cl:42][CH2:43][Cl:44]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([N:14]([CH2:15][c:16]2[n:17][cH:18][cH:19][cH:20][c:21]2[C:22]([CH3:23])([CH3:24])[c:25]2[cH:26][cH:27][c:28]([F:31])[cH:29][cH:30]2)[CH2:40][c:34]2[c:33]([CH3:32])[cH:38][c:37]([CH3:39])[cH:36][n:35]2)[CH2:12][CH2:13]1

참가 물질

4

반응물 3

HCID 6344DichloromethaneHCID 187316833,5-Dimethylpyridine-2-carbaldehydeHCID 672721454-({3-[1-(4-Fluoro-phenyl)-1-methyl-ethyl]-pyridin-2-ylmethyl}-amino)-piperidine-1-carboxylic acid tert-butyl ester

생성물 1

HCID 672721664-((3,5-Dimethyl-pyridin-2-ylmethyl)-{3-[1-(4-fluoro-phenyl)-1-methyl-ethyl]-pyridin-2-ylmethyl}-amino)-piperidine-1-carboxylic acid tert-butyl ester

출처 및 근거

ORD 기록
ord-377b77e0c5c34b60a0301a0746eea7ae
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

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