2-{[9-(4-butoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-methyl-N-phenylacetamide
Chemical Structure Depiction of
2-{[9-(4-butoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-methyl-N-phenylacetamide
2-{[9-(4-butoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-methyl-N-phenylacetamide
Compound characteristics
| Compound ID: | F831-0997 |
| Compound Name: | 2-{[9-(4-butoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-methyl-N-phenylacetamide |
| Molecular Weight: | 486.6 |
| Molecular Formula: | C26 H26 N6 O2 S |
| Smiles: | CCCCOc1ccc(cc1)c1cc2c3nnc(n3ccn2n1)SCC(N(C)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0947 |
| logD: | 4.0498 |
| logSw: | -4.0703 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.839 |
| InChI Key: | UFHXQSIMRYMZFR-UHFFFAOYSA-N |