2-{[9-(4-chlorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-[(4-methylphenyl)methyl]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-methylphenyl)methyl]acetamide
2-{[9-(4-chlorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-[(4-methylphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | F831-0756 |
| Compound Name: | 2-{[9-(4-chlorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-[(4-methylphenyl)methyl]acetamide |
| Molecular Weight: | 462.96 |
| Molecular Formula: | C23 H19 Cl N6 O S |
| Smiles: | Cc1ccc(CNC(CSc2nnc3c4cc(c5ccc(cc5)[Cl])nn4ccn23)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9202 |
| logD: | 3.8499 |
| logSw: | -4.3559 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.779 |
| InChI Key: | JVFXZKHWZLHGAB-UHFFFAOYSA-N |