methyl {[2-(4-fluorophenyl)-4-oxo-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetate
Chemical Structure Depiction of
methyl {[2-(4-fluorophenyl)-4-oxo-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetate
methyl {[2-(4-fluorophenyl)-4-oxo-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | F835-0174 |
| Compound Name: | methyl {[2-(4-fluorophenyl)-4-oxo-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetate |
| Molecular Weight: | 334.33 |
| Molecular Formula: | C14 H11 F N4 O3 S |
| Smiles: | COC(CSC1=NNC(c2cc(c3ccc(cc3)F)nn12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1359 |
| logD: | 2.1343 |
| logSw: | -2.8064 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.165 |
| InChI Key: | CYFPJJQYRNFTMY-UHFFFAOYSA-N |