2-{[9-(4-butoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Chemical Structure Depiction of
2-{[9-(4-butoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
2-{[9-(4-butoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Compound characteristics
Compound ID: | F831-1026 |
Compound Name: | 2-{[9-(4-butoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-(4-fluorophenyl)acetamide |
Molecular Weight: | 490.56 |
Molecular Formula: | C25 H23 F N6 O2 S |
Smiles: | CCCCOc1ccc(cc1)c1cc2c3nnc(n3ccn2n1)SCC(Nc1ccc(cc1)F)=O |
Stereo: | ACHIRAL |
logP: | 4.6821 |
logD: | 4.6371 |
logSw: | -4.3741 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.875 |
InChI Key: | HEBRHZVYMMRKBB-UHFFFAOYSA-N |