N-(4-ethoxyphenyl)-2-{8-[(4-methylphenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide
Chemical Structure Depiction of
N-(4-ethoxyphenyl)-2-{8-[(4-methylphenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide
N-(4-ethoxyphenyl)-2-{8-[(4-methylphenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide
Compound characteristics
| Compound ID: | M451-0139 |
| Compound Name: | N-(4-ethoxyphenyl)-2-{8-[(4-methylphenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide |
| Molecular Weight: | 435.5 |
| Molecular Formula: | C22 H21 N5 O3 S |
| Smiles: | CCOc1ccc(cc1)NC(CN1C(N2C=CN=C(C2=N1)Sc1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5776 |
| logD: | 3.5776 |
| logSw: | -3.6069 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.71 |
| InChI Key: | IEWACYMHMLSLBL-UHFFFAOYSA-N |