1,4-Diazepan-5-one → 1-[3-(4-Chloro-3-fluorophenyl)prop-2-enoyl]-1,4-diazepan-5-one

HRID 98711

반응식

HRID 98711 반응식
[Cl:1][c:2]1[c:3]([F:13])[cH:4][c:5]([CH:6]=[CH:7][C:8](=[O:9])[OH:10])[cH:11][cH:12]1.[NH:14]1[CH2:15][CH2:16][NH:17][C:18](=[O:21])[CH2:19][CH2:20]1>>[Cl:1][c:2]1[c:3]([F:13])[cH:4][c:5]([CH:6]=[CH:7][C:8](=[O:10])[N:14]2[CH2:15][CH2:16][NH:17][C:18](=[O:21])[CH2:19][CH2:20]2)[cH:11][cH:12]1

참가 물질

3

반응물 2

HCID 27372641,4-Diazepan-5-oneHCID 27736453-(4-Chloro-3-fluorophenyl)prop-2-enoic acid

생성물 1

HCID 684321671-[3-(4-Chloro-3-fluorophenyl)prop-2-enoyl]-1,4-diazepan-5-one

출처 및 근거

ORD 기록
ord-38585f4cb05748429cdd75f4681b947d
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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