2-{8-[(4-fluorophenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}-N-(2-methylphenyl)acetamide
Chemical Structure Depiction of
2-{8-[(4-fluorophenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}-N-(2-methylphenyl)acetamide
2-{8-[(4-fluorophenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}-N-(2-methylphenyl)acetamide
Compound characteristics
| Compound ID: | M451-0002 |
| Compound Name: | 2-{8-[(4-fluorophenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}-N-(2-methylphenyl)acetamide |
| Molecular Weight: | 409.44 |
| Molecular Formula: | C20 H16 F N5 O2 S |
| Smiles: | Cc1ccccc1NC(CN1C(N2C=CN=C(C2=N1)Sc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6092 |
| logD: | 2.6092 |
| logSw: | -2.878 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.889 |
| InChI Key: | XXUIHOSRPYISHC-UHFFFAOYSA-N |