2-{[2-(2-fluorophenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(2-methoxy-5-methylphenyl)acetamide
Chemical Structure Depiction of
2-{[2-(2-fluorophenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(2-methoxy-5-methylphenyl)acetamide
2-{[2-(2-fluorophenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(2-methoxy-5-methylphenyl)acetamide
Compound characteristics
| Compound ID: | G199-3176 |
| Compound Name: | 2-{[2-(2-fluorophenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(2-methoxy-5-methylphenyl)acetamide |
| Molecular Weight: | 439.47 |
| Molecular Formula: | C21 H18 F N5 O3 S |
| Smiles: | Cc1ccc(c(c1)NC(CSC1=NC(c2ccccc2F)=NC2=CC(NN12)=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.4817 |
| logD: | 2.4817 |
| logSw: | -3.1014 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.015 |
| InChI Key: | JWIRLRIXCJFNIA-UHFFFAOYSA-N |