N-[(2,3-dimethoxyphenyl)methyl]-2-[4-oxo-2-(thiophen-2-yl)pyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]acetamide
Chemical Structure Depiction of
N-[(2,3-dimethoxyphenyl)methyl]-2-[4-oxo-2-(thiophen-2-yl)pyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]acetamide
N-[(2,3-dimethoxyphenyl)methyl]-2-[4-oxo-2-(thiophen-2-yl)pyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]acetamide
Compound characteristics
Compound ID: | E016-0566 |
Compound Name: | N-[(2,3-dimethoxyphenyl)methyl]-2-[4-oxo-2-(thiophen-2-yl)pyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]acetamide |
Molecular Weight: | 425.46 |
Molecular Formula: | C20 H19 N5 O4 S |
Smiles: | COc1cccc(CNC(CN2C(c3cc(c4cccs4)nn3C=N2)=O)=O)c1OC |
Stereo: | ACHIRAL |
logP: | 1.8946 |
logD: | 1.8946 |
logSw: | -2.7583 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 82.983 |
InChI Key: | SDIJOWYUHBNEEG-UHFFFAOYSA-N |