2-[9-(4-fluorophenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
Chemical Structure Depiction of
2-[9-(4-fluorophenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
2-[9-(4-fluorophenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
Compound characteristics
| Compound ID: | F833-0515 |
| Compound Name: | 2-[9-(4-fluorophenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]-N-[3-(methylsulfanyl)phenyl]acetamide |
| Molecular Weight: | 448.48 |
| Molecular Formula: | C22 H17 F N6 O2 S |
| Smiles: | CSc1cccc(c1)NC(CN1C(N2C=Cn3c(cc(c4ccc(cc4)F)n3)C2=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2681 |
| logD: | 3.2681 |
| logSw: | -3.4942 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.468 |
| InChI Key: | MWCIXDMYGGCCSA-UHFFFAOYSA-N |