Ethanone, 1-[7-[[2-[[4-(4-ethyl-1-piperazinyl)phenyl]amino]-4-pyridinyl]amino...
C27H32N6O
2919575-27-0 Copyright (C) 2023 ACS
  0  0  0     0  0            999 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS  34 38 0 0 0
M  V30 BEGIN ATOM
M  V30 1 N 5.1457 4.1156 0.0 0
M  V30 2 C 3.1885 1.4647 0.0 0
M  V30 3 C 2.7126 0.0000 0.0 0
M  V30 4 O 4.6949 1.7849 0.0 0
M  V30 5 N 10.4805 4.1156 0.0 0
M  V30 6 C 19.8164 9.5057 0.0 0
M  V30 7 C 21.1502 8.7357 0.0 0
M  V30 8 C 2.4782 4.1156 0.0 0
M  V30 9 C 3.8119 4.8856 0.0 0
M  V30 10 C 1.1446 4.8856 0.0 0
M  V30 11 N 2.1580 2.6091 0.0 0
M  V30 12 C 3.8119 6.4256 0.0 0
M  V30 13 C 0.0000 3.8550 0.0 0
M  V30 14 C 1.1446 6.4256 0.0 0
M  V30 15 C 0.6265 2.4482 0.0 0
M  V30 16 C 2.4782 7.1957 0.0 0
M  V30 17 C 6.4794 4.8856 0.0 0
M  V30 18 C 7.8131 4.1156 0.0 0
M  V30 19 C 6.4794 6.4256 0.0 0
M  V30 20 C 9.1467 4.8856 0.0 0
M  V30 21 C 7.8131 7.1957 0.0 0
M  V30 22 N 9.1467 6.4256 0.0 0
M  V30 23 C 11.8142 4.8856 0.0 0
M  V30 24 C 13.1479 4.1156 0.0 0
M  V30 25 C 11.8142 6.4256 0.0 0
M  V30 26 C 14.4816 4.8856 0.0 0
M  V30 27 C 13.1479 7.1957 0.0 0
M  V30 28 C 14.4816 6.4256 0.0 0
M  V30 29 N 15.8154 7.1957 0.0 0
M  V30 30 C 15.8154 8.7357 0.0 0
M  V30 31 C 17.1490 6.4256 0.0 0
M  V30 32 C 17.1490 9.5057 0.0 0
M  V30 33 C 18.4827 7.1957 0.0 0
M  V30 34 N 18.4827 8.7357 0.0 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 1 1 9
M  V30 2 1 1 17
M  V30 3 1 2 3
M  V30 4 2 2 4
M  V30 5 1 2 11
M  V30 6 1 5 20
M  V30 7 1 5 23
M  V30 8 1 6 7
M  V30 9 1 6 34
M  V30 10 2 8 9
M  V30 11 1 8 10
M  V30 12 1 8 11
M  V30 13 1 9 12
M  V30 14 1 10 13
M  V30 15 2 10 14
M  V30 16 1 11 15
M  V30 17 2 12 16
M  V30 18 1 13 15
M  V30 19 1 14 16
M  V30 20 1 17 18
M  V30 21 2 17 19
M  V30 22 2 18 20
M  V30 23 1 19 21
M  V30 24 1 20 22
M  V30 25 2 21 22
M  V30 26 2 23 24
M  V30 27 1 23 25
M  V30 28 1 24 26
M  V30 29 2 25 27
M  V30 30 2 26 28
M  V30 31 1 27 28
M  V30 32 1 28 29
M  V30 33 1 29 30
M  V30 34 1 29 31
M  V30 35 1 30 32
M  V30 36 1 31 33
M  V30 37 1 32 34
M  V30 38 1 33 34
M  V30 END BOND
M  V30 END CTAB
M  END
> <cas.rn>
2919575-27-0

> <cas.index.name>
Ethanone, 1-[7-[[2-[[4-(4-ethyl-1-piperazinyl)phenyl]amino]-4-pyridinyl]amino]-2,3-dihydro-1H-indol-1-yl]-

> <molecular.formula>
C27H32N6O

> <molecular.weight>
456.58

> <boiling.point.predicted>
677.0±55.0 °C    Press: 760 Torr

> <density.predicted>
1.243±0.06 g/cm3    Temp: 20 °C; Press: 760 Torr

> <pka.predicted>
8.22±0.10    Most Basic Temp: 25 °C

$$$$
