N-(2-methoxyphenyl)-2-{8-[(3-methylphenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide
Chemical Structure Depiction of
N-(2-methoxyphenyl)-2-{8-[(3-methylphenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide
N-(2-methoxyphenyl)-2-{8-[(3-methylphenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide
Compound characteristics
| Compound ID: | M451-0356 |
| Compound Name: | N-(2-methoxyphenyl)-2-{8-[(3-methylphenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide |
| Molecular Weight: | 421.48 |
| Molecular Formula: | C21 H19 N5 O3 S |
| Smiles: | Cc1cccc(c1)SC1C2=NN(CC(Nc3ccccc3OC)=O)C(N2C=CN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7926 |
| logD: | 2.7926 |
| logSw: | -3.2289 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.519 |
| InChI Key: | MMLMVYATNFYKAD-UHFFFAOYSA-N |