2-[9-(4-chlorophenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]-N-(3-cyanophenyl)acetamide
Chemical Structure Depiction of
2-[9-(4-chlorophenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]-N-(3-cyanophenyl)acetamide
2-[9-(4-chlorophenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]-N-(3-cyanophenyl)acetamide
Compound characteristics
| Compound ID: | F833-0586 |
| Compound Name: | 2-[9-(4-chlorophenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]-N-(3-cyanophenyl)acetamide |
| Molecular Weight: | 443.85 |
| Molecular Formula: | C22 H14 Cl N7 O2 |
| Smiles: | C(C(Nc1cccc(C#N)c1)=O)N1C(N2C=Cn3c(cc(c4ccc(cc4)[Cl])n3)C2=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2338 |
| logD: | 3.2338 |
| logSw: | -3.728 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.525 |
| InChI Key: | REEIJJVDHSMVNN-UHFFFAOYSA-N |