Hydrochloric Acid → 2-(5-{3-[(4-Cyclopropyl-5-fluoropyrimidin-2-yl)-amino]-5-fluorophenyl}-1,3-thiazol-2-yl)propane-1,2-diol

반응식

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

참가 물질

반응물 3

HCID 313Hydrochloric Acid

HCID 887Methanol

HCID 672611911-{[Tert-butyl(dimethyl)silyl]oxy}-2-(5-{3-[(4-cyclopropyl-5-fluoropyrimidin-2-yl)amino]-5-fluorophenyl}-1,3-thiazol-2-yl)propan-2-ol

생성물 1

HCID 584561652-(5-{3-[(4-Cyclopropyl-5-fluoropyrimidin-2-yl)-amino]-5-fluorophenyl}-1,3-thiazol-2-yl)propane-1,2-diol

출처 및 근거

ORD 기록: ord-829864b942f647129fb6ebcaf544a6b5
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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