7-{[(4-ethenylphenyl)methyl]sulfanyl}-2-(furan-2-yl)pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one
Chemical Structure Depiction of
7-{[(4-ethenylphenyl)methyl]sulfanyl}-2-(furan-2-yl)pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one
7-{[(4-ethenylphenyl)methyl]sulfanyl}-2-(furan-2-yl)pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one
Compound characteristics
| Compound ID: | F835-0612 |
| Compound Name: | 7-{[(4-ethenylphenyl)methyl]sulfanyl}-2-(furan-2-yl)pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one |
| Molecular Weight: | 350.4 |
| Molecular Formula: | C18 H14 N4 O2 S |
| Smiles: | C=Cc1ccc(CSC2=NNC(c3cc(c4ccco4)nn23)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3318 |
| logD: | 3.3307 |
| logSw: | -3.5401 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.893 |
| InChI Key: | JMSIIEBTCMURDN-UHFFFAOYSA-N |