Hydrochloric Acid → AZD5363 (Capivasertib)

HRID 671415노트

반응식

HRID 671415 반응식
[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([CH2:9][CH2:10][OH:11])[NH:12][C:13](=[O:14])[C:15]2([NH:30][C:31](=[O:32])[O:33][C:34]([CH3:35])([CH3:36])[CH3:37])[CH2:16][CH2:17][N:18]([c:21]3[c:22]4[c:23]([n:24][cH:25][n:26]3)[nH:27][cH:28][cH:29]4)[CH2:19][CH2:20]2)[cH:6][cH:7]1.[ClH:38].[O:39]1[CH2:40][CH2:41][O:42][CH2:43][CH2:44]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([CH2:9][CH2:10][OH:11])[NH:12][C:13](=[O:14])[C:15]2([NH2:30])[CH2:16][CH2:17][N:18]([c:21]3[c:22]4[c:23]([n:24][cH:25][n:26]3)[nH:27][cH:28][cH:29]4)[CH2:19][CH2:20]2)[cH:6][cH:7]1

참가 물질

4

반응물 3

HCID 313Hydrochloric AcidHCID 312751,4-DioxaneHCID 57750387tert-butyl 4-(1-(4-chlorophenyl)-3-hydroxypropylcarbamoyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidin-4-ylcarbamate

생성물 1

HCID 42602260AZD5363 (Capivasertib)

출처 및 근거

ORD 기록
ord-bcdeae0c1d50476aa3b3852a02dec4d3
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

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