ethyl 4-[2-(3-oxo-8-phenoxy[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl)acetamido]benzoate
Chemical Structure Depiction of
ethyl 4-[2-(3-oxo-8-phenoxy[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl)acetamido]benzoate
ethyl 4-[2-(3-oxo-8-phenoxy[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | M446-0055 |
| Compound Name: | ethyl 4-[2-(3-oxo-8-phenoxy[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl)acetamido]benzoate |
| Molecular Weight: | 433.42 |
| Molecular Formula: | C22 H19 N5 O5 |
| Smiles: | CCOC(c1ccc(cc1)NC(CN1C(N2C=CN=C(C2=N1)Oc1ccccc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7642 |
| logD: | 2.7641 |
| logSw: | -3.1071 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.968 |
| InChI Key: | TYXKDSIALPEQGV-UHFFFAOYSA-N |