Hydrochloric Acid → 3-({[1,6-diethyl-4-(tetrahydro-2H-pyran-4-ylamino)-1H-pyrazolo[3,4-b]pyridin-5-yl]methyl}amino)-2,2-dimethyl-3-oxopropanoic acid

HRID 1217815

Reaktionsgleichung

Reaktionsgleichung von HRID 1217815
[CH3:24][C:25]([C:26](=[O:27])[OH:28])([C:29](=[O:30])[OH:31])[CH3:32].[CH3:57][CH2:58][N:59]([CH2:60][CH3:61])[CH2:62][CH3:63].[Cl:64][CH2:65][Cl:66].[ClH:1].[NH2:2][CH2:3][c:4]1[c:5]([NH:17][CH:18]2[CH2:19][CH2:20][O:21][CH2:22][CH2:23]2)[c:6]2[c:7]([n:8][c:9]1[CH2:10][CH3:11])[n:12]([CH2:15][CH3:16])[n:13][cH:14]2.[P-:33]([F:34])([F:35])([F:36])([F:37])([F:38])[F:39].[n:40]1([O:41][C:42]([N:43]([CH3:44])[CH3:45])=[N+:46]([CH3:47])[CH3:48])[c:49]2[cH:50][cH:51][cH:52][cH:53][c:54]2[n:55][n:56]1>>[NH:2]([CH2:3][c:4]1[c:5]([NH:17][CH:18]2[CH2:19][CH2:20][O:21][CH2:22][CH2:23]2)[c:6]2[c:7]([n:8][c:9]1[CH2:10][CH3:11])[n:12]([CH2:15][CH3:16])[n:13][cH:14]2)[C:29]([C:25]([CH3:24])([C:26](=[O:27])[OH:28])[CH3:32])=[O:30]

Komponenten

8

Edukt 7

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 8471TriethylamineHCID 9886HexafluorophosphateHCID 11686Dimethylmalonic acidHCID 130500O-benzotriazol-1-yl-tetramethyluroniumHCID 596832145-(Aminomethyl)-1,6-diethyl-N-(tetrahydro-2H-pyran-4-yl)-1H-pyrazolo[3,4-b]pyridin-4-amine

Produkt 1

HCID 578198733-({[1,6-diethyl-4-(tetrahydro-2H-pyran-4-ylamino)-1H-pyrazolo[3,4-b]pyridin-5-yl]methyl}amino)-2,2-dimethyl-3-oxopropanoic acid

Quellen und Nachweise

ORD-Eintrag
ord-83d117b14ae5436daba2264d7452cfe2
Quelldatensatz
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

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