2-{[9-(4-chlorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-(4-cyanophenyl)acetamide
Chemical Structure Depiction of
2-{[9-(4-chlorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-(4-cyanophenyl)acetamide
2-{[9-(4-chlorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-(4-cyanophenyl)acetamide
Compound characteristics
| Compound ID: | F831-0699 |
| Compound Name: | 2-{[9-(4-chlorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-(4-cyanophenyl)acetamide |
| Molecular Weight: | 459.92 |
| Molecular Formula: | C22 H14 Cl N7 O S |
| Smiles: | C(C(Nc1ccc(C#N)cc1)=O)Sc1nnc2c3cc(c4ccc(cc4)[Cl])nn3ccn12 |
| Stereo: | ACHIRAL |
| logP: | 3.4699 |
| logD: | 3.3993 |
| logSw: | -4.0892 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.514 |
| InChI Key: | PPVCLSAEQQKNAB-UHFFFAOYSA-N |