2-{[2-(4-ethylphenyl)-4-oxo-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}-N-(3-methyl-1H-pyrazol-5-yl)acetamide
Chemical Structure Depiction of
2-{[2-(4-ethylphenyl)-4-oxo-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}-N-(3-methyl-1H-pyrazol-5-yl)acetamide
2-{[2-(4-ethylphenyl)-4-oxo-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}-N-(3-methyl-1H-pyrazol-5-yl)acetamide
Compound characteristics
| Compound ID: | F424-1098 |
| Compound Name: | 2-{[2-(4-ethylphenyl)-4-oxo-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}-N-(3-methyl-1H-pyrazol-5-yl)acetamide |
| Molecular Weight: | 409.47 |
| Molecular Formula: | C19 H19 N7 O2 S |
| Smiles: | CCc1ccc(cc1)c1cc2C(NN=C(n2n1)SCC(Nc1cc(C)n[nH]1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8863 |
| logD: | 2.8847 |
| logSw: | -3.2022 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 97.599 |
| InChI Key: | WCUVENNKXXCXBX-UHFFFAOYSA-N |