N-benzyl-2-{[9-(3,4-dimethylphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-benzyl-2-{[9-(3,4-dimethylphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}acetamide
N-benzyl-2-{[9-(3,4-dimethylphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | F831-0859 |
| Compound Name: | N-benzyl-2-{[9-(3,4-dimethylphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 442.54 |
| Molecular Formula: | C24 H22 N6 O S |
| Smiles: | Cc1ccc(cc1C)c1cc2c3nnc(n3ccn2n1)SCC(NCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7644 |
| logD: | 3.2328 |
| logSw: | -3.8847 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.779 |
| InChI Key: | ZBJWVPLSFFDNFF-UHFFFAOYSA-N |