2-{8-[(3-methylphenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}-N-[(thiophen-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-{8-[(3-methylphenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}-N-[(thiophen-2-yl)methyl]acetamide
2-{8-[(3-methylphenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}-N-[(thiophen-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | M451-1316 |
| Compound Name: | 2-{8-[(3-methylphenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}-N-[(thiophen-2-yl)methyl]acetamide |
| Molecular Weight: | 411.5 |
| Molecular Formula: | C19 H17 N5 O2 S2 |
| Smiles: | Cc1cccc(c1)SC1C2=NN(CC(NCc3cccs3)=O)C(N2C=CN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5922 |
| logD: | 2.5922 |
| logSw: | -2.8067 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.927 |
| InChI Key: | UZRDRUGUUXRWJG-UHFFFAOYSA-N |