methyl 3-{2-[2-(4-ethoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]acetamido}thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-{2-[2-(4-ethoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]acetamido}thiophene-2-carboxylate
methyl 3-{2-[2-(4-ethoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]acetamido}thiophene-2-carboxylate
Compound characteristics
| Compound ID: | G419-0450 |
| Compound Name: | methyl 3-{2-[2-(4-ethoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]acetamido}thiophene-2-carboxylate |
| Molecular Weight: | 452.49 |
| Molecular Formula: | C22 H20 N4 O5 S |
| Smiles: | CCOc1ccc(cc1)c1cc2C(N(CC(Nc3ccsc3C(=O)OC)=O)C=Cn2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3276 |
| logD: | 2.2999 |
| logSw: | -2.9799 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.738 |
| InChI Key: | VARYOKHPFVMYEV-UHFFFAOYSA-N |