N-cyclohexyl-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-cyclohexyl-2-{[9-(4-fluorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}acetamide
N-cyclohexyl-2-{[9-(4-fluorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | F831-0652 |
| Compound Name: | N-cyclohexyl-2-{[9-(4-fluorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 424.5 |
| Molecular Formula: | C21 H21 F N6 O S |
| Smiles: | C1CCC(CC1)NC(CSc1nnc2c3cc(c4ccc(cc4)F)nn3ccn12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1458 |
| logD: | 3.1233 |
| logSw: | -3.3831 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.505 |
| InChI Key: | OQUNAYAUSBZIRM-UHFFFAOYSA-N |