N-(4-methoxyphenyl)-2-{[2-(4-methylphenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-methoxyphenyl)-2-{[2-(4-methylphenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}acetamide
N-(4-methoxyphenyl)-2-{[2-(4-methylphenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}acetamide
Compound characteristics
Compound ID: | G199-0386 |
Compound Name: | N-(4-methoxyphenyl)-2-{[2-(4-methylphenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}acetamide |
Molecular Weight: | 421.48 |
Molecular Formula: | C21 H19 N5 O3 S |
Smiles: | Cc1ccc(cc1)C1=NC2=CC(NN2C(=N1)SCC(Nc1ccc(cc1)OC)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.129 |
logD: | 3.129 |
logSw: | -3.4818 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 80.626 |
InChI Key: | HZLRGHFYHLIAEJ-UHFFFAOYSA-N |