N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-oxo-8-phenoxy[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl)acetamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-oxo-8-phenoxy[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl)acetamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-oxo-8-phenoxy[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl)acetamide
Compound characteristics
| Compound ID: | M446-0922 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-oxo-8-phenoxy[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl)acetamide |
| Molecular Weight: | 449.47 |
| Molecular Formula: | C23 H23 N5 O5 |
| Smiles: | COc1ccc(CCNC(CN2C(N3C=CN=C(C3=N2)Oc2ccccc2)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.0323 |
| logD: | 1.0323 |
| logSw: | -2.2306 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.639 |
| InChI Key: | VFLSJEXIJAHXSV-UHFFFAOYSA-N |