2-[8-(benzylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-phenylacetamide
Chemical Structure Depiction of
2-[8-(benzylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-phenylacetamide
2-[8-(benzylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-phenylacetamide
Compound characteristics
| Compound ID: | M451-3360 |
| Compound Name: | 2-[8-(benzylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-phenylacetamide |
| Molecular Weight: | 391.45 |
| Molecular Formula: | C20 H17 N5 O2 S |
| Smiles: | C(C(Nc1ccccc1)=O)N1C(N2C=CN=C(C2=N1)SCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1723 |
| logD: | 2.1723 |
| logSw: | -2.5999 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.586 |
| InChI Key: | XNTGRHCUHYNDMF-UHFFFAOYSA-N |