N-(2-fluorophenyl)-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-(2-fluorophenyl)-2-{[2-(4-methylphenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}acetamide
N-(2-fluorophenyl)-2-{[2-(4-methylphenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}acetamide
Compound characteristics
Compound ID: | G199-0379 |
Compound Name: | N-(2-fluorophenyl)-2-{[2-(4-methylphenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}acetamide |
Molecular Weight: | 409.44 |
Molecular Formula: | C20 H16 F N5 O2 S |
Smiles: | Cc1ccc(cc1)C1=NC2=CC(NN2C(=N1)SCC(Nc1ccccc1F)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.9267 |
logD: | 2.9266 |
logSw: | -3.3692 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 72.384 |
InChI Key: | WOKNBSSNZGUBME-UHFFFAOYSA-N |