7-{[2-(2,5-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-2-(furan-2-yl)pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one
Chemical Structure Depiction of
7-{[2-(2,5-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-2-(furan-2-yl)pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one
7-{[2-(2,5-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-2-(furan-2-yl)pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one
Compound characteristics
| Compound ID: | F835-0638 |
| Compound Name: | 7-{[2-(2,5-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-2-(furan-2-yl)pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one |
| Molecular Weight: | 412.42 |
| Molecular Formula: | C19 H16 N4 O5 S |
| Smiles: | COc1ccc(c(c1)C(CSC1=NNC(c2cc(c3ccco3)nn12)=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.6525 |
| logD: | 2.6495 |
| logSw: | -3.1678 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.314 |
| InChI Key: | XPUKHYKTSYCYRB-UHFFFAOYSA-N |