2-{[9-(4-butoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-(4-fluorophenyl)-N-methylacetamide
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)-N-methylacetamide
2-{[9-(4-butoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-(4-fluorophenyl)-N-methylacetamide
Compound characteristics
| Compound ID: | F831-1051 |
| Compound Name: | 2-{[9-(4-butoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-(4-fluorophenyl)-N-methylacetamide |
| Molecular Weight: | 504.59 |
| Molecular Formula: | C26 H25 F N6 O2 S |
| Smiles: | CCCCOc1ccc(cc1)c1cc2c3nnc(n3ccn2n1)SCC(N(C)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2454 |
| logD: | 4.2004 |
| logSw: | -4.1482 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.839 |
| InChI Key: | DZHKYWCRJKUPAL-UHFFFAOYSA-N |