3-[(3-Chloro-2-methoxyphenyl)amino]-2-[3-[(2S)-1,4-dioxan-2-ylmethoxy]-4-pyri...
C24H25ClN4O5
2521285-05-0 Copyright (C) 2024 ACS
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    2.2890    4.0976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8242    3.6217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.1584    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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  1 23  1  0  0  0  0
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  3  4  1  0  0  0  0
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 29  4  1  1  0  0  0
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M  END
> <cas.rn>
2521285-05-0

> <cas.index.name>
4H-Pyrrolo[3,2-c]pyridin-4-one, 3-[(3-chloro-2-methoxyphenyl)amino]-2-[3-[(2S)-1,4-dioxan-2-ylmethoxy]-4-pyridinyl]-1,5,6,7-tetrahydro-

> <molecular.formula>
C24H25ClN4O5

> <molecular.weight>
484.93

> <boiling.point.predicted>
730.779±60.00 °C    Press: 760.00 Torr

> <density.predicted>
1.361±0.06 g/cm3    Temp: 25 °C; Press: 760 Torr

> <pka.predicted>
13.375±0.20    Most Acidic Temp: 25 °C

$$$$
