2-{[2-(4-fluorophenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[2-(4-fluorophenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
2-{[2-(4-fluorophenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | G199-1198 |
| Compound Name: | 2-{[2-(4-fluorophenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide |
| Molecular Weight: | 425.44 |
| Molecular Formula: | C20 H16 F N5 O3 S |
| Smiles: | COc1ccc(cc1)NC(CSC1=NC(c2ccc(cc2)F)=NC2=CC(NN12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7346 |
| logD: | 2.7346 |
| logSw: | -3.3669 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.626 |
| InChI Key: | GMTDUJYGPBBIAI-UHFFFAOYSA-N |