N-(3,4-dimethoxyphenyl)-2-{[4-oxo-2-(thiophen-2-yl)-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-2-{[4-oxo-2-(thiophen-2-yl)-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide
N-(3,4-dimethoxyphenyl)-2-{[4-oxo-2-(thiophen-2-yl)-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide
Compound characteristics
Compound ID: | F424-0752 |
Compound Name: | N-(3,4-dimethoxyphenyl)-2-{[4-oxo-2-(thiophen-2-yl)-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide |
Molecular Weight: | 443.5 |
Molecular Formula: | C19 H17 N5 O4 S2 |
Smiles: | COc1ccc(cc1OC)NC(CSC1=NNC(c2cc(c3cccs3)nn12)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.6857 |
logD: | 2.6841 |
logSw: | -3.1452 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 90.743 |
InChI Key: | DDUYKEMPNJPZSH-UHFFFAOYSA-N |