2-(Dimethylamino)acetyl chloride → HCID 25253066, Verbindung

HRID 1880835

Reaktionsgleichung

Reaktionsgleichung von HRID 1880835
[CH:1]1([N:6]2[CH2:12][C:11]([F:14])([F:13])[C:10](=[O:15])[N:9]([CH3:16])[C:8]3[CH:17]=[N:18][C:19]([NH:21][C:22]4[CH:36]=[CH:35][C:25]([C:26]([NH:28][CH:29]5[CH2:34][CH2:33][NH:32][CH2:31][CH2:30]5)=[O:27])=[CH:24][C:23]=4[O:37][CH3:38])=[N:20][C:7]2=3)[CH2:5][CH2:4][CH2:3][CH2:2]1.[CH3:39][N:40]([CH3:45])[CH2:41][C:42](Cl)=[O:43]>>[CH:1]1([N:6]2[CH2:12][C:11]([F:13])([F:14])[C:10](=[O:15])[N:9]([CH3:16])[C:8]3[CH:17]=[N:18][C:19]([NH:21][C:22]4[CH:36]=[CH:35][C:25]([C:26]([NH:28][CH:29]5[CH2:34][CH2:33][N:32]([C:42](=[O:43])[CH2:41][N:40]([CH3:45])[CH3:39])[CH2:31][CH2:30]5)=[O:27])=[CH:24][C:23]=4[O:37][CH3:38])=[N:20][C:7]2=3)[CH2:2][CH2:3][CH2:4][CH2:5]1

Komponenten

3

Edukt 2

HCID 70103442-(Dimethylamino)acetyl chlorideHCID 252530654-(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-(piperidin-4-yl)benzamide

Produkt 1

HCID 25253066HCID 25253066, Verbindung

Versuchsvorschrift

The title compound was synthesized from 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-(piperidin-4-yl)benzamide in accordance with scheme 6 using 2-(dimethylamino)acetyl chloride. 1H NMR (400 MHz, DMSO-d6) δ ppm 1.38 (dd, J=13.1, 4.0 Hz, 1 H) 1.58 (m, 5 H) 1.71 (m, 2 H) 1.83 (m, 2 H) 1.93 (m, 2 H) 2.21 (s, 5 H) 2.52 (d, J=1.8 Hz, 1 H) 2.63-2.73 (m, 1 H) 3.05 (t, J=12.1 Hz, 2 H) 3.17-3.24 (m, 1 H) 3.32 (s, 5 H) 3.93 (s, 3 H) 4.05 (t, J=14.2 Hz, 3 H) 4.36 (d, J=12.6 Hz, 1 H) 4.77 (q, J=8.3 Hz, 1 H) 7.48 (dd, 1 H) 7.50 (s, 1 H) 7.97 (s, 1 H) 8.17 (d, J=7.8 Hz, 1 H) 8.26 (s, 1 H) 8.29 (d, 1H). [M+H] calc'd for C30H40F2N8O4, 615; found 615.

Quellen und Nachweise

ORD-Eintrag
ord-05d72ead91cd4757b5daffbafb1b84f8
Quelldatensatz
uspto-grants-2012_11
Patentnummer
US08318727B2

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