2-[8-(3,5-dimethylphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-(4-fluorophenyl)acetamide
Chemical Structure Depiction of
2-[8-(3,5-dimethylphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-(4-fluorophenyl)acetamide
2-[8-(3,5-dimethylphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-(4-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | M446-2087 |
| Compound Name: | 2-[8-(3,5-dimethylphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-(4-fluorophenyl)acetamide |
| Molecular Weight: | 407.4 |
| Molecular Formula: | C21 H18 F N5 O3 |
| Smiles: | Cc1cc(C)cc(c1)OC1C2=NN(CC(Nc3ccc(cc3)F)=O)C(N2C=CN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.003 |
| logD: | 3.003 |
| logSw: | -3.2973 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.214 |
| InChI Key: | IHMQQXLHIIZOMS-UHFFFAOYSA-N |