2-{[9-(4-chlorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-(5-fluoro-2-methylphenyl)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-(5-fluoro-2-methylphenyl)acetamide
2-{[9-(4-chlorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-(5-fluoro-2-methylphenyl)acetamide
Compound characteristics
| Compound ID: | F831-0732 |
| Compound Name: | 2-{[9-(4-chlorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-(5-fluoro-2-methylphenyl)acetamide |
| Molecular Weight: | 466.92 |
| Molecular Formula: | C22 H16 Cl F N6 O S |
| Smiles: | Cc1ccc(cc1NC(CSc1nnc2c3cc(c4ccc(cc4)[Cl])nn3ccn12)=O)F |
| Stereo: | ACHIRAL |
| logP: | 3.7378 |
| logD: | 3.6673 |
| logSw: | -4.2924 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.76 |
| InChI Key: | XPNMLUFKJCDDNA-UHFFFAOYSA-N |