N-(4-ethoxyphenyl)-2-{7-[(2-methylphenyl)methyl]-3,8-dioxo-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide
Chemical Structure Depiction of
N-(4-ethoxyphenyl)-2-{7-[(2-methylphenyl)methyl]-3,8-dioxo-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide
N-(4-ethoxyphenyl)-2-{7-[(2-methylphenyl)methyl]-3,8-dioxo-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide
Compound characteristics
| Compound ID: | S448-0100 |
| Compound Name: | N-(4-ethoxyphenyl)-2-{7-[(2-methylphenyl)methyl]-3,8-dioxo-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide |
| Molecular Weight: | 435.48 |
| Molecular Formula: | C23 H25 N5 O4 |
| Smiles: | CCOc1ccc(cc1)NC(CN1C(N2CCN(Cc3ccccc3C)C(C2=N1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.459 |
| logD: | 3.459 |
| logSw: | -3.284 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.905 |
| InChI Key: | SKRUIQCGWRRGIX-UHFFFAOYSA-N |