N-(2,4-Dimethoxyphenyl)-N-(1-oxo-2-propyn-1-yl)-2-(2-thienyl)glycylglycine et...
C21H22N2O6S
1401089-31-3 Copyright (C) 2025 ACS
 30 31  0  0  0  0  0  0  0  0999 V2000
    6.6687    4.6799    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
> <cas.rn>
1401089-31-3

> <ca.index.name>
Glycine, N-(2,4-dimethoxyphenyl)-N-(1-oxo-2-propyn-1-yl)-2-(2-thienyl)glycyl-, ethyl ester

> <molecular.formula>
C21H22N2O6S

> <smiles.canonical>
O=C(C#C)N(C1=CC=C(OC)C=C1OC)C(C(=O)NCC(=O)OCC)C=2SC=CC2

> <molecular.weight>
430.48

> <density.predicted>
1.296±0.06 g/cm3    Temp: 25 °C; Press: 760 Torr

> <pka.predicted>
12.326±0.46    Most Acidic Temp: 25 °C

$$$$
