N-(2,6-dimethylphenyl)-2-{[9-(4-fluorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2,6-dimethylphenyl)-2-{[9-(4-fluorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}acetamide
N-(2,6-dimethylphenyl)-2-{[9-(4-fluorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | F831-0606 |
| Compound Name: | N-(2,6-dimethylphenyl)-2-{[9-(4-fluorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 446.5 |
| Molecular Formula: | C23 H19 F N6 O S |
| Smiles: | Cc1cccc(C)c1NC(CSc1nnc2c3cc(c4ccc(cc4)F)nn3ccn12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4345 |
| logD: | 3.412 |
| logSw: | -3.7226 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.062 |
| InChI Key: | RKLGPSDJLIGFEN-UHFFFAOYSA-N |