methyl 3-{2-[8-(3-methoxyphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamido}benzoate
Chemical Structure Depiction of
methyl 3-{2-[8-(3-methoxyphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamido}benzoate
methyl 3-{2-[8-(3-methoxyphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | M446-0396 |
| Compound Name: | methyl 3-{2-[8-(3-methoxyphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamido}benzoate |
| Molecular Weight: | 449.42 |
| Molecular Formula: | C22 H19 N5 O6 |
| Smiles: | COC(c1cccc(c1)NC(CN1C(N2C=CN=C(C2=N1)Oc1cccc(c1)OC)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4242 |
| logD: | 2.4242 |
| logSw: | -2.9976 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.932 |
| InChI Key: | NIYDOWOHYSWHAV-UHFFFAOYSA-N |