N-(5-chloro-2-methoxyphenyl)-2-{[9-(4-fluorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-2-{[9-(4-fluorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}acetamide
N-(5-chloro-2-methoxyphenyl)-2-{[9-(4-fluorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | F831-0601 |
| Compound Name: | N-(5-chloro-2-methoxyphenyl)-2-{[9-(4-fluorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 482.92 |
| Molecular Formula: | C22 H16 Cl F N6 O2 S |
| Smiles: | COc1ccc(cc1NC(CSc1nnc2c3cc(c4ccc(cc4)F)nn3ccn12)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.5027 |
| logD: | 3.4768 |
| logSw: | -4.0852 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.39 |
| InChI Key: | WWVFEUUWVJWLQO-UHFFFAOYSA-N |