Dichloromethane → [4-fluoro-2-(tetrahydro-2H-pyran-4-yloxy)-phenyl]-(5,6,7,8-tetrahydro-pyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)-amine

HRID 1125008노트

반응식

[C:8]([O:9][C:10](=[O:11])[N:15]1[CH2:16][c:17]2[c:18]([c:19]3[c:20]([n:21][cH:22][n:23][c:24]3[NH:25][c:26]3[c:27]([O:33][CH:34]4[CH2:35][CH2:36][O:37][CH2:38][CH2:39]4)[cH:28][c:29]([F:32])[cH:30][cH:31]3)[s:40]2)[CH2:41][CH2:42]1)([CH3:12])([CH3:13])[CH3:14].[Cl:43][CH2:44][Cl:45].[OH:1][C:2]([C:3]([F:4])([F:5])[F:6])=[O:7]>>[NH:15]1[CH2:16][c:17]2[c:18]([c:19]3[c:20]([n:21][cH:22][n:23][c:24]3[NH:25][c:26]3[c:27]([O:33][CH:34]4[CH2:35][CH2:36][O:37][CH2:38][CH2:39]4)[cH:28][c:29]([F:32])[cH:30][cH:31]3)[s:40]2)[CH2:41][CH2:42]1

참가 물질

반응물 3

HCID 6344Dichloromethane

HCID 6422Trifluoroacetic acid

HCID 696691144-[4-Fluoro-2-(tetrahydro-2H-pyran-4-yloxy)-phenylamino]-5,8-dihydro-6H-pyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7-carboxylic acid tert-butyl ester

생성물 1

HCID 46182217[4-fluoro-2-(tetrahydro-2H-pyran-4-yloxy)-phenyl]-(5,6,7,8-tetrahydro-pyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)-amine

출처 및 근거

ORD 기록: ord-496a9b23344c439899b569ad33cd885a
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

반응 노트

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