4-[2,3-Dihydro-7-methoxy-3-methyl-8-(1-methyl-1H-pyrazol-4-yl)-2-oxo-1H-imida...
C23H17FN6O2
1360628-91-6 Copyright (C) 2023 ACS
  0  0  0     0  0            999 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS  32 36 0 0 0
M  V30 BEGIN ATOM
M  V30 1 O 1.3628 4.2275 0.0 0
M  V30 2 C 0.0000 7.2883 0.0 0
M  V30 3 F 2.7126 2.7930 0.0 0
M  V30 4 O 9.3193 10.3086 0.0 0
M  V30 5 C 9.3193 11.8486 0.0 0
M  V30 6 C 7.7862 1.1444 0.0 0
M  V30 7 N 8.8166 0.0000 0.0 0
M  V30 8 C 13.2882 6.8716 0.0 0
M  V30 9 C 3.9845 7.2286 0.0 0
M  V30 10 C 5.3182 7.9986 0.0 0
M  V30 11 N 3.6643 5.7223 0.0 0
M  V30 12 C 2.6508 7.9986 0.0 0
M  V30 13 C 5.3182 9.5386 0.0 0
M  V30 14 C 6.6520 7.2286 0.0 0
M  V30 15 C 2.1328 5.5613 0.0 0
M  V30 16 N 1.5063 6.9681 0.0 0
M  V30 17 C 2.6508 9.5386 0.0 0
M  V30 18 C 6.6520 10.3086 0.0 0
M  V30 19 N 3.9845 10.3086 0.0 0
M  V30 20 C 7.9856 7.9986 0.0 0
M  V30 21 C 7.9856 9.5386 0.0 0
M  V30 22 C 4.6948 4.5777 0.0 0
M  V30 23 C 4.2189 3.1132 0.0 0
M  V30 24 C 6.2012 4.8980 0.0 0
M  V30 25 C 5.2493 1.9686 0.0 0
M  V30 26 C 7.2316 3.7535 0.0 0
M  V30 27 C 6.7558 2.2889 0.0 0
M  V30 28 C 9.3193 7.2286 0.0 0
M  V30 29 C 10.7263 7.8550 0.0 0
M  V30 30 C 9.4802 5.6970 0.0 0
M  V30 31 N 11.7567 6.7105 0.0 0
M  V30 32 N 10.9867 5.3768 0.0 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 2 1 15
M  V30 2 1 2 16
M  V30 3 1 3 23
M  V30 4 1 4 5
M  V30 5 1 4 21
M  V30 6 3 6 7
M  V30 7 1 6 27
M  V30 8 1 8 31
M  V30 9 1 9 10
M  V30 10 1 9 11
M  V30 11 2 9 12
M  V30 12 1 10 13
M  V30 13 2 10 14
M  V30 14 1 11 15
M  V30 15 1 11 22
M  V30 16 1 12 16
M  V30 17 1 12 17
M  V30 18 2 13 18
M  V30 19 1 13 19
M  V30 20 1 14 20
M  V30 21 1 15 16
M  V30 22 2 17 19
M  V30 23 1 18 21
M  V30 24 2 20 21
M  V30 25 1 20 28
M  V30 26 2 22 23
M  V30 27 1 22 24
M  V30 28 1 23 25
M  V30 29 2 24 26
M  V30 30 2 25 27
M  V30 31 1 26 27
M  V30 32 2 28 29
M  V30 33 1 28 30
M  V30 34 1 29 31
M  V30 35 2 30 32
M  V30 36 1 31 32
M  V30 END BOND
M  V30 END CTAB
M  END
> <cas.rn>
1360628-91-6

> <cas.index.name>
Benzonitrile, 4-[2,3-dihydro-7-methoxy-3-methyl-8-(1-methyl-1H-pyrazol-4-yl)-2-oxo-1H-imidazo[4,5-c]quinolin-1-yl]-3-fluoro-

> <molecular.formula>
C23H17FN6O2

> <molecular.weight>
428.42

> <boiling.point.predicted>
634.8±65.0 °C    Press: 760 Torr

> <density.predicted>
1.41±0.1 g/cm3    Temp: 20 °C; Press: 760 Torr

> <pka.predicted>
5.36±0.20    Most Basic Temp: 25 °C

$$$$
