Dimethylformamide → 7-Chloro-3-{[(6-morpholin-4-yl-pyridine-3-carbonyl)-amino]-methyl}-4-oxo-1-phenyl-1,4-dihydro-quinoline-2-carboxylic acid dimethylamide

HRID 303483

반응식

HRID 303483 반응식
[Br:23][P+:24]([N:25]1[CH2:26][CH2:27][CH2:28][CH2:29]1)([N:30]1[CH2:31][CH2:32][CH2:33][CH2:34]1)[N:35]1[CH2:36][CH2:37][CH2:38][CH2:39]1.[CH3:40][CH2:41][N:42]([CH2:43][CH3:44])[CH2:45][CH3:46].[NH2:47][CH2:48][c:49]1[c:50]([C:67](=[O:68])[N:69]([CH3:70])[CH3:71])[n:51](-[c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[c:52]2[cH:53][c:54]([Cl:60])[cH:55][cH:56][c:57]2[c:58]1=[O:59].[O:1]1[CH2:2][CH2:3][N:4]([c:7]2[n:8][cH:9][c:10]([C:11](=[O:12])[OH:13])[cH:14][cH:15]2)[CH2:5][CH2:6]1.[O:72]=[CH:73][N:74]([CH3:75])[CH3:76].[P-:16]([F:17])([F:18])([F:19])([F:20])([F:21])[F:22]>>[O:1]1[CH2:2][CH2:3][N:4]([c:7]2[n:8][cH:9][c:10]([C:11](=[O:13])[NH:47][CH2:48][c:49]3[c:50]([C:67](=[O:68])[N:69]([CH3:70])[CH3:71])[n:51](-[c:61]4[cH:62][cH:63][cH:64][cH:65][cH:66]4)[c:52]4[cH:53][c:54]([Cl:60])[cH:55][cH:56][c:57]4[c:58]3=[O:59])[cH:14][cH:15]2)[CH2:5][CH2:6]1

참가 물질

7

반응물 6

HCID 6228DimethylformamideHCID 8471TriethylamineHCID 9886HexafluorophosphateHCID 2733180Bromotripyrrolidin-1-ylphosphoniumHCID 27764606-Morpholinonicotinic AcidHCID 712086753-(aminomethyl)-7-chloro-N,N-dimethyl-4-oxo-1-phenyl-1,4-dihydroquinoline-2-carboxamide

생성물 1

HCID 712081737-Chloro-3-{[(6-morpholin-4-yl-pyridine-3-carbonyl)-amino]-methyl}-4-oxo-1-phenyl-1,4-dihydro-quinoline-2-carboxylic acid dimethylamide

출처 및 근거

ORD 기록
ord-f84f29b4606a48aca87fb662b2861a13
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

연결된 노트

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