2-{[9-(4-butoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-(propan-2-yl)acetamide
Chemical Structure Depiction of
2-{[9-(4-butoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-(propan-2-yl)acetamide
2-{[9-(4-butoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-(propan-2-yl)acetamide
Compound characteristics
| Compound ID: | F831-1052 |
| Compound Name: | 2-{[9-(4-butoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-(propan-2-yl)acetamide |
| Molecular Weight: | 438.55 |
| Molecular Formula: | C22 H26 N6 O2 S |
| Smiles: | CCCCOc1ccc(cc1)c1cc2c3nnc(n3ccn2n1)SCC(NC(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4127 |
| logD: | 3.3677 |
| logSw: | -3.7078 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.443 |
| InChI Key: | DOHUAJJXPWDTLD-UHFFFAOYSA-N |