N,3-Dimethyl-6-[6-(4-methyl-1-piperazinyl)-1-(phenylmethyl)-1H-benzimidazol-2...
C26H29N9
1610044-98-8 Copyright (C) 2024 ACS
  0  0  0     0  0            999 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS  35 40 0 0 0
M  V30 BEGIN ATOM
M  V30 1 C 8.0980 3.2573 0.0 0
M  V30 2 N 3.7036 0.7700 0.0 0
M  V30 3 C 2.3698 0.0000 0.0 0
M  V30 4 C 0.4294 6.5604 0.0 0
M  V30 5 C 17.2783 7.2417 0.0 0
M  V30 6 N 7.7778 4.7636 0.0 0
M  V30 7 C 6.3709 5.3900 0.0 0
M  V30 8 C 8.8082 5.9081 0.0 0
M  V30 9 N 6.5318 6.9216 0.0 0
M  V30 10 C 8.0382 7.2417 0.0 0
M  V30 11 C 10.3482 5.9081 0.0 0
M  V30 12 C 8.8082 8.5754 0.0 0
M  V30 13 C 11.1182 7.2417 0.0 0
M  V30 14 C 10.3482 8.5754 0.0 0
M  V30 15 C 5.0372 4.6200 0.0 0
M  V30 16 C 3.7036 5.3900 0.0 0
M  V30 17 N 5.0372 3.0800 0.0 0
M  V30 18 N 2.3698 4.6200 0.0 0
M  V30 19 C 3.7036 2.3100 0.0 0
M  V30 20 C 2.3698 3.0800 0.0 0
M  V30 21 C 0.9052 5.0959 0.0 0
M  V30 22 N 0.9052 2.6042 0.0 0
M  V30 23 N 0.0000 3.8500 0.0 0
M  V30 24 C 9.5625 2.7814 0.0 0
M  V30 25 C 10.7071 3.8118 0.0 0
M  V30 26 C 9.8827 1.2750 0.0 0
M  V30 27 C 12.1716 3.3360 0.0 0
M  V30 28 C 11.3474 0.7991 0.0 0
M  V30 29 C 12.4918 1.8295 0.0 0
M  V30 30 N 12.6582 7.2417 0.0 0
M  V30 31 C 13.4283 5.9081 0.0 0
M  V30 32 C 13.4283 8.5754 0.0 0
M  V30 33 C 14.9683 5.9081 0.0 0
M  V30 34 C 14.9683 8.5754 0.0 0
M  V30 35 N 15.7383 7.2417 0.0 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 1 1 6
M  V30 2 1 1 24
M  V30 3 1 2 3
M  V30 4 1 2 19
M  V30 5 1 4 21
M  V30 6 1 5 35
M  V30 7 1 6 7
M  V30 8 1 6 8
M  V30 9 2 7 9
M  V30 10 1 7 15
M  V30 11 1 8 10
M  V30 12 2 8 11
M  V30 13 1 9 10
M  V30 14 2 10 12
M  V30 15 1 11 13
M  V30 16 1 12 14
M  V30 17 2 13 14
M  V30 18 1 13 30
M  V30 19 2 15 16
M  V30 20 1 15 17
M  V30 21 1 16 18
M  V30 22 2 17 19
M  V30 23 1 18 20
M  V30 24 1 18 21
M  V30 25 1 19 20
M  V30 26 2 20 22
M  V30 27 2 21 23
M  V30 28 1 22 23
M  V30 29 2 24 25
M  V30 30 1 24 26
M  V30 31 1 25 27
M  V30 32 2 26 28
M  V30 33 2 27 29
M  V30 34 1 28 29
M  V30 35 1 30 31
M  V30 36 1 30 32
M  V30 37 1 31 33
M  V30 38 1 32 34
M  V30 39 1 33 35
M  V30 40 1 34 35
M  V30 END BOND
M  V30 END CTAB
M  END
> <cas.rn>
1610044-98-8

> <cas.index.name>
1,2,4-Triazolo[4,3-a]pyrazin-8-amine, N,3-dimethyl-6-[6-(4-methyl-1-piperazinyl)-1-(phenylmethyl)-1H-benzimidazol-2-yl]-

> <molecular.formula>
C26H29N9

> <molecular.weight>
467.57

> <density.predicted>
1.36±0.1 g/cm3    Temp: 20 °C; Press: 760 Torr

> <pka.predicted>
7.70±0.42    Most Basic Temp: 25 °C

$$$$
