N-[1,4-Dihydro-4-[3-(5-methyl-2-furanyl)-1-phenyl-1H-pyrazol-4-yl]-1,3,5-tria...
C25H21N7O2
2479378-45-3 Copyright (C) 2023 ACS
  0  0  0     0  0            999 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS  34 39 0 0 0
M  V30 BEGIN ATOM
M  V30 1 N 12.3668 6.2265 0.0 0
M  V30 2 C 13.7007 6.9965 0.0 0
M  V30 3 C 15.0343 6.2265 0.0 0
M  V30 4 O 13.7007 8.5365 0.0 0
M  V30 5 C 9.5817 0.0000 0.0 0
M  V30 6 N 8.3659 8.5365 0.0 0
M  V30 7 C 8.3659 6.9965 0.0 0
M  V30 8 C 7.2213 9.5669 0.0 0
M  V30 9 C 9.6995 9.3065 0.0 0
M  V30 10 N 9.6995 6.2265 0.0 0
M  V30 11 C 7.8478 10.9739 0.0 0
M  V30 12 C 5.6898 9.4060 0.0 0
M  V30 13 N 9.3794 10.8128 0.0 0
M  V30 14 N 11.0332 8.5365 0.0 0
M  V30 15 C 11.0332 6.9965 0.0 0
M  V30 16 C 6.9426 12.2198 0.0 0
M  V30 17 C 4.7845 10.6519 0.0 0
M  V30 18 C 5.4110 12.0587 0.0 0
M  V30 19 C 7.0320 6.2265 0.0 0
M  V30 20 C 6.8711 4.6949 0.0 0
M  V30 21 C 5.6252 6.8528 0.0 0
M  V30 22 N 5.3648 4.3746 0.0 0
M  V30 23 N 4.5948 5.7084 0.0 0
M  V30 24 C 8.0157 3.6643 0.0 0
M  V30 25 O 7.8546 2.1328 0.0 0
M  V30 26 C 9.5220 3.9845 0.0 0
M  V30 27 C 9.2615 1.5064 0.0 0
M  V30 28 C 10.2920 2.6508 0.0 0
M  V30 29 C 3.0631 5.8693 0.0 0
M  V30 30 C 2.1580 4.6235 0.0 0
M  V30 31 C 2.4368 7.2761 0.0 0
M  V30 32 C 0.6263 4.7844 0.0 0
M  V30 33 C 0.9052 7.4372 0.0 0
M  V30 34 C 0.0000 6.1914 0.0 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 1 1 2
M  V30 2 1 1 15
M  V30 3 1 2 3
M  V30 4 2 2 4
M  V30 5 1 5 27
M  V30 6 1 6 7
M  V30 7 1 6 8
M  V30 8 1 6 9
M  V30 9 1 7 10
M  V30 10 1 7 19
M  V30 11 1 8 11
M  V30 12 2 8 12
M  V30 13 1 9 13
M  V30 14 2 9 14
M  V30 15 2 10 15
M  V30 16 1 11 13
M  V30 17 2 11 16
M  V30 18 1 12 17
M  V30 19 1 14 15
M  V30 20 1 16 18
M  V30 21 2 17 18
M  V30 22 1 19 20
M  V30 23 2 19 21
M  V30 24 2 20 22
M  V30 25 1 20 24
M  V30 26 1 21 23
M  V30 27 1 22 23
M  V30 28 1 23 29
M  V30 29 1 24 25
M  V30 30 2 24 26
M  V30 31 1 25 27
M  V30 32 1 26 28
M  V30 33 2 27 28
M  V30 34 2 29 30
M  V30 35 1 29 31
M  V30 36 1 30 32
M  V30 37 2 31 33
M  V30 38 2 32 34
M  V30 39 1 33 34
M  V30 END BOND
M  V30 END CTAB
M  END
> <cas.rn>
2479378-45-3

> <cas.index.name>
Acetamide, N-[1,4-dihydro-4-[3-(5-methyl-2-furanyl)-1-phenyl-1H-pyrazol-4-yl]-1,3,5-triazino[1,2-a]benzimidazol-2-yl]-

> <molecular.formula>
C25H21N7O2

> <molecular.weight>
451.48

> <density.predicted>
1.45±0.1 g/cm3    Temp: 20 °C; Press: 760 Torr

> <pka.predicted>
9.76±0.40    Most Acidic Temp: 25 °C

$$$$
