Hydrochloric Acid → 4-[({4-[(3-Chloro-2-fluorophenyl)amino]-7-methoxyquinazolin-6-yl}methyl)(methyl)amino]piperidine-4-carboxylic acid
반응식
[C:1]([O:2][C:3](=[O:4])[N:8]1[CH2:9][CH2:10][C:11]([C:14](=[O:15])[OH:16])([N:17]([CH3:18])[CH2:19][c:20]2[cH:21][c:22]3[c:23]([NH:32][c:33]4[c:34]([F:40])[c:35]([Cl:39])[cH:36][cH:37][cH:38]4)[n:24][cH:25][n:26][c:27]3[cH:28][c:29]2[O:30][CH3:31])[CH2:12][CH2:13]1)([CH3:5])([CH3:6])[CH3:7].[ClH:41].[O:42]1[CH2:43][CH2:44][O:45][CH2:46][CH2:47]1>>[NH:8]1[CH2:9][CH2:10][C:11]([C:14](=[O:15])[OH:16])([N:17]([CH3:18])[CH2:19][c:20]2[cH:21][c:22]3[c:23]([NH:32][c:33]4[c:34]([F:40])[c:35]([Cl:39])[cH:36][cH:37][cH:38]4)[n:24][cH:25][n:26][c:27]3[cH:28][c:29]2[O:30][CH3:31])[CH2:12][CH2:13]1참가 물질
4
반응물 3
생성물 1
출처 및 근거
- ORD 기록
- ord-7601d23bd5644377828c5dce07bf6122
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)