2-Ethoxy-3′-fluoro-N-(1H-indazol-7-ylmethyl)-N-methyl[1,1′-biphenyl]-4-carbox...
C24H22FN3O2
2842012-69-3 Copyright (C) 2024 ACS
  0  0  0     0  0            999 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS  30 33 0 0 0
M  V30 BEGIN ATOM
M  V30 1 O 4.6201 2.6673 0.0 0
M  V30 2 C 5.3901 1.3337 0.0 0
M  V30 3 C 4.6201 0.0000 0.0 0
M  V30 4 C 9.2402 5.3348 0.0 0
M  V30 5 N 10.0102 6.6685 0.0 0
M  V30 6 O 10.0102 4.0012 0.0 0
M  V30 7 C 11.5503 6.6685 0.0 0
M  V30 8 C 9.2402 8.0023 0.0 0
M  V30 9 F 0.0000 8.0023 0.0 0
M  V30 10 C 4.6201 5.3348 0.0 0
M  V30 11 C 5.3901 4.0012 0.0 0
M  V30 12 C 5.3901 6.6685 0.0 0
M  V30 13 C 6.9302 4.0012 0.0 0
M  V30 14 C 6.9302 6.6685 0.0 0
M  V30 15 C 7.7002 5.3348 0.0 0
M  V30 16 C 3.0801 5.3348 0.0 0
M  V30 17 C 2.3101 6.6685 0.0 0
M  V30 18 C 2.3101 4.0012 0.0 0
M  V30 19 C 0.7700 6.6685 0.0 0
M  V30 20 C 0.7700 4.0012 0.0 0
M  V30 21 C 0.0000 5.3348 0.0 0
M  V30 22 C 12.3203 8.0023 0.0 0
M  V30 23 C 13.8603 8.0022 0.0 0
M  V30 24 C 11.5503 9.3360 0.0 0
M  V30 25 C 14.6303 9.3360 0.0 0
M  V30 26 N 14.8907 6.8578 0.0 0
M  V30 27 C 12.3203 10.6697 0.0 0
M  V30 28 C 16.1366 9.0158 0.0 0
M  V30 29 C 13.8603 10.6697 0.0 0
M  V30 30 N 16.2976 7.4841 0.0 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 1 1 2
M  V30 2 1 1 11
M  V30 3 1 2 3
M  V30 4 1 4 5
M  V30 5 2 4 6
M  V30 6 1 4 15
M  V30 7 1 5 7
M  V30 8 1 5 8
M  V30 9 1 7 22
M  V30 10 1 9 19
M  V30 11 2 10 11
M  V30 12 1 10 12
M  V30 13 1 10 16
M  V30 14 1 11 13
M  V30 15 2 12 14
M  V30 16 2 13 15
M  V30 17 1 14 15
M  V30 18 2 16 17
M  V30 19 1 16 18
M  V30 20 1 17 19
M  V30 21 2 18 20
M  V30 22 2 19 21
M  V30 23 1 20 21
M  V30 24 2 22 23
M  V30 25 1 22 24
M  V30 26 1 23 25
M  V30 27 1 23 26
M  V30 28 2 24 27
M  V30 29 1 25 28
M  V30 30 2 25 29
M  V30 31 1 26 30
M  V30 32 1 27 29
M  V30 33 2 28 30
M  V30 END BOND
M  V30 END CTAB
M  END
> <cas.rn>
2842012-69-3

> <cas.index.name>
[1,1′-Biphenyl]-4-carboxamide, 2-ethoxy-3′-fluoro-N-(1H-indazol-7-ylmethyl)-N-methyl-

> <molecular.formula>
C24H22FN3O2

> <molecular.weight>
403.45

> <boiling.point.predicted>
621.6±55.0 °C    Press: 760 Torr

> <density.predicted>
1.256±0.06 g/cm3    Temp: 20 °C; Press: 760 Torr

> <pka.predicted>
13.60±0.40    Most Acidic Temp: 25 °C

$$$$
