N-(4-fluorophenyl)-2-{[7-oxo-2-(thiophen-2-yl)-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-2-{[7-oxo-2-(thiophen-2-yl)-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}acetamide
N-(4-fluorophenyl)-2-{[7-oxo-2-(thiophen-2-yl)-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}acetamide
Compound characteristics
Compound ID: | G199-1888 |
Compound Name: | N-(4-fluorophenyl)-2-{[7-oxo-2-(thiophen-2-yl)-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}acetamide |
Molecular Weight: | 401.44 |
Molecular Formula: | C17 H12 F N5 O2 S2 |
Smiles: | C(C(Nc1ccc(cc1)F)=O)SC1=NC(c2cccs2)=NC2=CC(NN12)=O |
Stereo: | ACHIRAL |
logP: | 2.5892 |
logD: | 2.5891 |
logSw: | -2.9588 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 74.101 |
InChI Key: | KPZRFBCZKHORKC-UHFFFAOYSA-N |