2-(3,4-dimethoxyphenyl)-7-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one
Chemical Structure Depiction of
2-(3,4-dimethoxyphenyl)-7-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one
2-(3,4-dimethoxyphenyl)-7-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one
Compound characteristics
| Compound ID: | F424-0579 |
| Compound Name: | 2-(3,4-dimethoxyphenyl)-7-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one |
| Molecular Weight: | 443.52 |
| Molecular Formula: | C21 H25 N5 O4 S |
| Smiles: | CC1CCN(CC1)C(CSC1=NNC(c2cc(c3ccc(c(c3)OC)OC)nn12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5806 |
| logD: | 2.5789 |
| logSw: | -2.9836 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.968 |
| InChI Key: | WAWPLLPBFVMUKS-UHFFFAOYSA-N |