Water → 4-(9-cyclopentyl-7,7-difluoro-5-methyl-6-oxo-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b][1,4]diazepin-2-ylamino)-3-methoxy-N-(2,2,6,6-tetramethyl-piperidin-4-yl)-benzamide

HRID 149420

Reaktionsgleichung

Reaktionsgleichung von HRID 149420
[CH2:33]([N:34]([CH:35]([CH3:36])[CH3:37])[CH:38]([CH3:39])[CH3:40])[CH3:41].[CH3:42][C:43]1([CH3:52])[NH:44][C:45]([CH3:50])([CH3:51])[CH2:46][CH:47]([NH2:49])[CH2:48]1.[CH3:53][N:54]([CH3:55])[CH:56]=[O:57].[CH:1]1([N:6]2[c:7]3[c:8]([cH:17][n:18][c:19]([NH:21][c:22]4[c:23]([O:31][CH3:32])[cH:24][c:25]([C:26](=[O:27])[OH:28])[cH:29][cH:30]4)[n:20]3)[N:9]([CH3:16])[C:10](=[O:15])[C:11]([F:13])([F:14])[CH2:12]2)[CH2:2][CH2:3][CH2:4][CH2:5]1.[OH2:58]>>[CH:1]1([N:6]2[c:7]3[c:8]([cH:17][n:18][c:19]([NH:21][c:22]4[c:23]([O:31][CH3:32])[cH:24][c:25]([C:26](=[O:28])[NH:49][CH:47]5[CH2:46][C:45]([CH3:50])([CH3:51])[NH:44][C:43]([CH3:42])([CH3:52])[CH2:48]5)[cH:29][cH:30]4)[n:20]3)[N:9]([CH3:16])[C:10](=[O:15])[C:11]([F:13])([F:14])[CH2:12]2)[CH2:2][CH2:3][CH2:4][CH2:5]1

Komponenten

6

Edukt 5

HCID 962WaterHCID 6228DimethylformamideHCID 375244-Amino-2,2,6,6-tetramethylpiperidineHCID 81531DiisopropylethylamineHCID 252529054-(9-Cyclopentyl-7,7-difluoro-5-methyl-6-oxo-6,7,8,9-tetrahydro-5H-pyrimido[5,4-b][1,4]diazepin-2-ylamino)-3-methoxybenzoic acid

Produkt 1

HCID 445486154-(9-cyclopentyl-7,7-difluoro-5-methyl-6-oxo-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b][1,4]diazepin-2-ylamino)-3-methoxy-N-(2,2,6,6-tetramethyl-piperidin-4-yl)-benzamide

Quellen und Nachweise

ORD-Eintrag
ord-a82f3dcfeb4e4c0c97d70a6cd565327d
Quelldatensatz
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

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