4,5-Dimethyl-N-(2-phenyl-1H-pyrrolo[2,3-b]pyridin-5-yl)-1H-pyrazole-3-carboxa...
C19H17N5O
1616385-51-3 Copyright (C) 2023 ACS
  0  0  0     0  0            999 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS  25 28 0 0 0
M  V30 BEGIN ATOM
M  V30 1 N 10.9910 1.8517 0.0 0
M  V30 2 C 12.3249 2.6217 0.0 0
M  V30 3 O 12.3249 4.1618 0.0 0
M  V30 4 C 15.3855 3.9845 0.0 0
M  V30 5 C 17.6275 1.4946 0.0 0
M  V30 6 C 6.9900 2.6217 0.0 0
M  V30 7 C 6.9900 4.1618 0.0 0
M  V30 8 C 5.5253 2.1459 0.0 0
M  V30 9 C 8.3237 1.8517 0.0 0
M  V30 10 N 5.5253 4.6376 0.0 0
M  V30 11 N 8.3237 4.9318 0.0 0
M  V30 12 C 4.6201 3.3918 0.0 0
M  V30 13 C 9.6574 2.6217 0.0 0
M  V30 14 C 9.6574 4.1618 0.0 0
M  V30 15 C 3.0801 3.3918 0.0 0
M  V30 16 C 2.3100 4.7254 0.0 0
M  V30 17 C 2.3100 2.0581 0.0 0
M  V30 18 C 0.7700 4.7254 0.0 0
M  V30 19 C 0.7700 2.0581 0.0 0
M  V30 20 C 0.0000 3.3918 0.0 0
M  V30 21 C 13.6585 1.8517 0.0 0
M  V30 22 C 15.0653 2.4782 0.0 0
M  V30 23 N 13.8194 0.3202 0.0 0
M  V30 24 C 16.0959 1.3337 0.0 0
M  V30 25 N 15.3259 0.0000 0.0 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 1 1 2
M  V30 2 1 1 13
M  V30 3 2 2 3
M  V30 4 1 2 21
M  V30 5 1 4 22
M  V30 6 1 5 24
M  V30 7 1 6 7
M  V30 8 1 6 8
M  V30 9 2 6 9
M  V30 10 1 7 10
M  V30 11 2 7 11
M  V30 12 2 8 12
M  V30 13 1 9 13
M  V30 14 1 10 12
M  V30 15 1 11 14
M  V30 16 1 12 15
M  V30 17 2 13 14
M  V30 18 2 15 16
M  V30 19 1 15 17
M  V30 20 1 16 18
M  V30 21 2 17 19
M  V30 22 2 18 20
M  V30 23 1 19 20
M  V30 24 1 21 22
M  V30 25 2 21 23
M  V30 26 2 22 24
M  V30 27 1 23 25
M  V30 28 1 24 25
M  V30 END BOND
M  V30 END CTAB
M  END
> <cas.rn>
1616385-51-3

> <cas.index.name>
1H-Pyrazole-3-carboxamide, 4,5-dimethyl-N-(2-phenyl-1H-pyrrolo[2,3-b]pyridin-5-yl)-

> <molecular.formula>
C19H17N5O

> <molecular.weight>
331.37

> <density.predicted>
1.361±0.06 g/cm3    Temp: 20 °C; Press: 760 Torr

> <pka.predicted>
11.97±0.43    Most Acidic Temp: 25 °C

$$$$
