N-{[4-(methylsulfanyl)phenyl]methyl}-3-(9-phenylpyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl)propanamide
Chemical Structure Depiction of
N-{[4-(methylsulfanyl)phenyl]methyl}-3-(9-phenylpyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl)propanamide
N-{[4-(methylsulfanyl)phenyl]methyl}-3-(9-phenylpyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl)propanamide
Compound characteristics
| Compound ID: | F832-0053 |
| Compound Name: | N-{[4-(methylsulfanyl)phenyl]methyl}-3-(9-phenylpyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl)propanamide |
| Molecular Weight: | 442.54 |
| Molecular Formula: | C24 H22 N6 O S |
| Smiles: | CSc1ccc(CNC(CCc2nnc3c4cc(c5ccccc5)nn4ccn23)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.8396 |
| logD: | 2.737 |
| logSw: | -3.3906 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.174 |
| InChI Key: | FSXQCEDAWVZIAY-UHFFFAOYSA-N |