ethyl 4-{2-[8-(2,3-dimethylphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 4-{2-[8-(2,3-dimethylphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamido}benzoate
ethyl 4-{2-[8-(2,3-dimethylphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | M446-1413 |
| Compound Name: | ethyl 4-{2-[8-(2,3-dimethylphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamido}benzoate |
| Molecular Weight: | 461.48 |
| Molecular Formula: | C24 H23 N5 O5 |
| Smiles: | CCOC(c1ccc(cc1)NC(CN1C(N2C=CN=C(C2=N1)Oc1cccc(C)c1C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5836 |
| logD: | 3.5836 |
| logSw: | -3.7098 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.055 |
| InChI Key: | AGYPHYZGBLZSLI-UHFFFAOYSA-N |