Dichloromethane → [4-(1-Chloropyrido[3,4-d]pyridazin-4-yl)-2-methylpiperazin-1-yl]-piperidin-1-ylmethanone

HRID 174449

반응식

HRID 174449 반응식
[CH3:19][CH2:20][N:21]([CH2:22][CH3:23])[CH2:24][CH3:25].[CH3:38][CH2:39][O:40][C:41](=[O:42])[CH3:43].[Cl:1][c:2]1[c:3]2[c:4]([c:5]([N:8]3[CH2:9][CH:10]([CH3:14])[NH:11][CH2:12][CH2:13]3)[n:6][n:7]1)[cH:15][n:16][cH:17][cH:18]2.[Cl:35][CH2:36][Cl:37].[N:26]1([C:32](=[O:33])[Cl:34])[CH2:27][CH2:28][CH2:29][CH2:30][CH2:31]1>>[Cl:1][c:2]1[c:3]2[c:4]([c:5]([N:8]3[CH2:9][CH:10]([CH3:14])[N:11]([C:32]([N:26]4[CH2:27][CH2:28][CH2:29][CH2:30][CH2:31]4)=[O:33])[CH2:12][CH2:13]3)[n:6][n:7]1)[cH:15][n:16][cH:17][cH:18]2

참가 물질

6

반응물 5

HCID 6344DichloromethaneHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 2420851-Piperidinecarbonyl chlorideHCID 765851571-Chloro-4-(3-methylpiperazin-1-yl)pyrido[3,4-d]pyridazine

생성물 1

HCID 76585156[4-(1-Chloropyrido[3,4-d]pyridazin-4-yl)-2-methylpiperazin-1-yl]-piperidin-1-ylmethanone

출처 및 근거

ORD 기록
ord-74b0e3c8f40b4f428c288851a0ae54ff
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

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