(2R)-2-[[[3-Cyclobutyl-5-(3,4,5-trifluorophenoxy)-3H-imidazo[4,5-b]pyridin-2-...
C20H20F3N5O2
2512197-69-0 Copyright (C) 2024 ACS
 30 33  0  0  1  0  0  0  0  0999 V2000
   13.2456    4.7819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0156    6.1155    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.5556    6.1155    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   16.3256    7.4492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3256    4.7819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8656    7.4492    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.5556    8.7830    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3347    3.2419    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.2419    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.6673    7.8619    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.3219    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   10.8004    3.5360    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.3358    4.0119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7056    4.7819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3358    5.5519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0020    3.2419    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.8004    6.0277    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.0020    6.3219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6684    4.0119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6684    5.5519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2762    2.0713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6484    1.3721    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5772    0.6992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9494    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0011    4.0119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6673    3.2419    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0011    5.5519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3336    4.0119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6673    6.3219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3336    5.5519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 14  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  1  0  0  0
  4  6  1  0  0  0  0
  4  7  2  0  0  0  0
  8 19  1  0  0  0  0
  8 25  1  0  0  0  0
  9 28  1  0  0  0  0
 10 29  1  0  0  0  0
 11 30  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  1  0  0  0  0
 12 21  1  0  0  0  0
 13 15  1  0  0  0  0
 13 16  2  0  0  0  0
 14 17  2  0  0  0  0
 15 17  1  0  0  0  0
 15 18  2  0  0  0  0
 16 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 20  2  0  0  0  0
 21 22  1  0  0  0  0
 21 23  1  0  0  0  0
 22 24  1  0  0  0  0
 23 24  1  0  0  0  0
 25 26  2  0  0  0  0
 25 27  1  0  0  0  0
 26 28  1  0  0  0  0
 27 29  2  0  0  0  0
 28 30  2  0  0  0  0
 29 30  1  0  0  0  0
M  END
> <cas.rn>
2512197-69-0

> <cas.index.name>
Propanamide, 2-[[[3-cyclobutyl-5-(3,4,5-trifluorophenoxy)-3H-imidazo[4,5-b]pyridin-2-yl]methyl]amino]-, (2R)-

> <molecular.formula>
C20H20F3N5O2

> <molecular.weight>
419.40

> <boiling.point.predicted>
607.8±55.0 °C    Press: 760 Torr

> <density.predicted>
1.53±0.1 g/cm3    Temp: 20 °C; Press: 760 Torr

> <pka.predicted>
15.94±0.50    Most Acidic Temp: 25 °C

$$$$
