methyl 2-{2-[9-(4-methylphenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]acetamido}benzoate
Chemical Structure Depiction of
methyl 2-{2-[9-(4-methylphenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]acetamido}benzoate
methyl 2-{2-[9-(4-methylphenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | F833-0371 |
| Compound Name: | methyl 2-{2-[9-(4-methylphenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]acetamido}benzoate |
| Molecular Weight: | 456.46 |
| Molecular Formula: | C24 H20 N6 O4 |
| Smiles: | Cc1ccc(cc1)c1cc2C3=NN(CC(Nc4ccccc4C(=O)OC)=O)C(N3C=Cn2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9261 |
| logD: | 2.922 |
| logSw: | -3.3659 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.945 |
| InChI Key: | ZCRLQZIUKUSDCD-UHFFFAOYSA-N |