3-Chloro-N,N-dimethyl-1-propanamine → 4-dimethylaminomethyl-2-methyl-8-phenyl-4H-pyrazolo[1,5-a]pyrazolo-[4',3':5,6]pyrido[3,4-e]pyrimidin-5(8H)-one

HRID 205077

반응식

HRID 205077 반응식
[C:13](=[O:14])([c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1)[n:21]1[c:22]2[n:23]([c:24]3[c:25]([c:26]1=[O:27])[cH:28][n:29][c:30]1[c:31]3[cH:32][n:33][n:34]1-[c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1)[n:41][c:42]([CH3:44])[cH:43]2.[CH3:1][N:2]([CH3:3])[CH2:4][Cl:5].[CH3:6][N:7]([CH2:8][CH2:9][CH2:10][Cl:11])[CH3:12]>>[CH3:1][N:2]([CH3:3])[CH2:4][n:21]1[c:22]2[n:23]([c:24]3[c:25]([c:26]1=[O:27])[cH:28][n:29][c:30]1[c:31]3[cH:32][n:33][n:34]1-[c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1)[n:41][c:42]([CH3:44])[cH:43]2

참가 물질

4

반응물 3

HCID 669603-Chloro-N,N-dimethyl-1-propanamineHCID 2630741-Chloro-N,N-dimethylmethanamineHCID 227574654-Benzoyl-2-methyl-8-phenyl-4H-pyrazolo[1,5-a]pyrazolo-[4',3':5,6]pyrido[3,4-e]pyrimidin-5(8H)-one

생성물 1

HCID 227574794-dimethylaminomethyl-2-methyl-8-phenyl-4H-pyrazolo[1,5-a]pyrazolo-[4',3':5,6]pyrido[3,4-e]pyrimidin-5(8H)-one

출처 및 근거

ORD 기록
ord-082b09f851a042898f7d86716b68c278
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

연결된 노트

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