6-Amino-1,4-dihydro-4-[5-(hydroxymethyl)[1,1′-biphenyl]-3-yl]-3-methyl-4-(1-m...
C24H24N4O2
2146095-85-2 Copyright (C) 2023 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 C 5.2537 7.1952 0.0 0
M  V30 2 C 5.5211 8.7118 0.0 0
M  V30 3 C 6.4333 6.2053 0.0 0
M  V30 4 C 2.8943 4.1619 0.0 0
M  V30 5 N 3.1616 2.6453 0.0 0
M  V30 6 C 6.0263 9.3449 0.0 0
M  V30 7 N 0.0000 5.2154 0.0 0
M  V30 8 C 3.8066 1.3336 0.0 0
M  V30 9 O 4.5766 0.0000 0.0 0
M  V30 10 C 3.8066 6.6684 0.0 0
M  V30 11 C 3.5391 8.1849 0.0 0
M  V30 12 C 2.6268 5.6784 0.0 0
M  V30 13 C 2.0921 8.7118 0.0 0
M  V30 14 C 4.4873 9.3986 0.0 0
M  V30 15 C 1.1798 6.2053 0.0 0
M  V30 16 O 0.9123 7.7219 0.0 0
M  V30 17 N 2.1457 10.2509 0.0 0
M  V30 18 N 3.6261 10.6753 0.0 0
M  V30 19 C 4.5766 5.3347 0.0 0
M  V30 20 C 6.1166 5.3347 0.0 0
M  V30 21 C 3.8066 4.0011 0.0 0
M  V30 22 C 6.8866 4.0011 0.0 0
M  V30 23 C 4.5766 2.6674 0.0 0
M  V30 24 C 6.1166 2.6674 0.0 0
M  V30 25 C 8.4266 4.0011 0.0 0
M  V30 26 C 9.1966 5.3347 0.0 0
M  V30 27 C 9.1966 2.6674 0.0 0
M  V30 28 C 10.7366 5.3347 0.0 0
M  V30 29 C 10.7366 2.6674 0.0 0
M  V30 30 C 11.5066 4.0011 0.0 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 1 1 2
M  V30 2 1 1 3
M  V30 3 1 1 10
M  V30 4 3 4 5
M  V30 5 1 4 12
M  V30 6 1 6 14
M  V30 7 1 7 15
M  V30 8 1 8 9
M  V30 9 1 8 23
M  V30 10 1 10 11
M  V30 11 1 10 12
M  V30 12 1 10 19
M  V30 13 2 11 13
M  V30 14 1 11 14
M  V30 15 2 12 15
M  V30 16 1 13 16
M  V30 17 1 13 17
M  V30 18 2 14 18
M  V30 19 1 15 16
M  V30 20 1 17 18
M  V30 21 2 19 20
M  V30 22 1 19 21
M  V30 23 1 20 22
M  V30 24 2 21 23
M  V30 25 2 22 24
M  V30 26 1 22 25
M  V30 27 1 23 24
M  V30 28 2 25 26
M  V30 29 1 25 27
M  V30 30 1 26 28
M  V30 31 2 27 29
M  V30 32 2 28 30
M  V30 33 1 29 30
M  V30 END BOND
M  V30 END CTAB
M  END
> <cas.rn>
2146095-85-2

> <cas.index.name>
Pyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-1,4-dihydro-4-[5-(hydroxymethyl)[1,1′-biphenyl]-3-yl]-3-methyl-4-(1-methylethyl)-

> <molecular.formula>
C24H24N4O2

> <molecular.weight>
400.47

> <boiling.point.predicted>
683.6±55.0 °C    Press: 760 Torr

> <density.predicted>
1.32±0.1 g/cm3    Temp: 20 °C; Press: 760 Torr

> <pka.predicted>
11.54±0.70    Most Acidic Temp: 25 °C

$$$$
