5-Amino-N-[(1R,2S)-2-[4-(phenylmethoxy)phenyl]cyclopropyl]-1,3,4-oxadiazole-2...
C19H20N4O2
1357362-02-7 Copyright (C) 2024 ACS
  0  0  0     0  0            999 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS  25 28 0 0 1
M  V30 BEGIN ATOM
M  V30 1 N 13.5434 4.6201 0.0 0
M  V30 2 C 14.8770 5.3901 0.0 0
M  V30 3 O 5.3348 2.3101 0.0 0
M  V30 4 C 4.0010 3.0801 0.0 0
M  V30 5 N 20.1797 4.2630 0.0 0
M  V30 6 C 10.6697 5.3901 0.0 0 CFG=2
M  V30 7 C 12.2097 5.3901 0.0 0 CFG=2
M  V30 8 C 11.4397 6.7238 0.0 0
M  V30 9 C 9.3358 4.6201 0.0 0
M  V30 10 C 9.3358 3.0801 0.0 0
M  V30 11 C 8.0022 5.3901 0.0 0
M  V30 12 C 8.0022 2.3101 0.0 0
M  V30 13 C 6.6685 4.6201 0.0 0
M  V30 14 C 6.6685 3.0801 0.0 0
M  V30 15 C 16.2107 4.6201 0.0 0
M  V30 16 N 16.3718 3.0885 0.0 0
M  V30 17 O 17.6177 5.2464 0.0 0
M  V30 18 N 17.8781 2.7684 0.0 0
M  V30 19 C 18.6481 4.1020 0.0 0
M  V30 20 C 2.6673 2.3101 0.0 0
M  V30 21 C 2.6673 0.7700 0.0 0
M  V30 22 C 1.3337 3.0801 0.0 0
M  V30 23 C 1.3337 0.0000 0.0 0
M  V30 24 C 0.0000 2.3101 0.0 0
M  V30 25 C 0.0000 0.7700 0.0 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 1 1 2
M  V30 2 1 7 1 CFG=1
M  V30 3 1 2 15
M  V30 4 1 3 4
M  V30 5 1 3 14
M  V30 6 1 4 20
M  V30 7 1 5 19
M  V30 8 1 6 7
M  V30 9 1 6 8
M  V30 10 1 6 9 CFG=3
M  V30 11 1 7 8
M  V30 12 2 9 10
M  V30 13 1 9 11
M  V30 14 1 10 12
M  V30 15 2 11 13
M  V30 16 2 12 14
M  V30 17 1 13 14
M  V30 18 2 15 16
M  V30 19 1 15 17
M  V30 20 1 16 18
M  V30 21 1 17 19
M  V30 22 2 18 19
M  V30 23 2 20 21
M  V30 24 1 20 22
M  V30 25 1 21 23
M  V30 26 2 22 24
M  V30 27 2 23 25
M  V30 28 1 24 25
M  V30 END BOND
M  V30 BEGIN COLLECTION
M  V30 MDLV30/STEABS ATOMS=(2 6 7)
M  V30 END COLLECTION
M  V30 END CTAB
M  END
> <cas.rn>
1357362-02-7

> <cas.index.name>
1,3,4-Oxadiazole-2-methanamine, 5-amino-N-[(1R,2S)-2-[4-(phenylmethoxy)phenyl]cyclopropyl]-

> <molecular.formula>
C19H20N4O2

> <molecular.weight>
336.39

> <boiling.point.predicted>
550.0±60.0 °C    Press: 760 Torr

> <density.predicted>
1.30±0.1 g/cm3    Temp: 20 °C; Press: 760 Torr

> <pka.predicted>
5.20±0.40    Most Basic Temp: 25 °C

$$$$
