3-[9-(4-chlorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide
Chemical Structure Depiction of
3-[9-(4-chlorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide
3-[9-(4-chlorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide
Compound characteristics
| Compound ID: | F832-0328 |
| Compound Name: | 3-[9-(4-chlorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide |
| Molecular Weight: | 476.99 |
| Molecular Formula: | C24 H21 Cl N6 O S |
| Smiles: | CSc1ccc(CNC(CCc2nnc3c4cc(c5ccc(cc5)[Cl])nn4ccn23)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.5394 |
| logD: | 3.4368 |
| logSw: | -4.1544 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.174 |
| InChI Key: | PHIQGGRKKWHEQY-UHFFFAOYSA-N |