N-(2-Aminophenyl)-5-[(phenylmethyl)amino]-2-pyrazinecarboxamide
C18H17N5O
2710273-81-5 Copyright (C) 2025 ACS
 24 26  0  0  0  0  0  0  0  0999 V2000
    5.3901    4.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6201    2.6675    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.6201    5.3348    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5501    4.0011    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.3201    5.3348    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0800    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.9301    4.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7001    2.6675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7001    5.3348    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.2401    2.6675    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.2401    5.3348    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0101    4.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0800    2.6675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3100    1.3338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3100    4.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7700    1.3338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7700    4.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.6675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8602    5.3348    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6302    6.6686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6302    4.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.1702    4.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9402    5.3348    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  7  1  0  0  0  0
  2 13  1  0  0  0  0
  4  5  1  0  0  0  0
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 23 24  1  0  0  0  0
M  END
> <cas.rn>
2710273-81-5

> <cas.index.name>
2-Pyrazinecarboxamide, N-(2-aminophenyl)-5-[(phenylmethyl)amino]-

> <molecular.formula>
C18H17N5O

> <molecular.weight>
319.36

> <boiling.point.predicted>
475.068±45.00 °C    Press: 760.00 Torr

> <density.predicted>
1.346±0.06 g/cm3    Temp: 25 °C; Press: 760 Torr

> <pka.predicted>
10.096±0.70    Most Acidic Temp: 25 °C

$$$$
