2-(4-ethoxyphenyl)-7-{[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]sulfanyl}pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one
Chemical Structure Depiction of
2-(4-ethoxyphenyl)-7-{[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]sulfanyl}pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one
2-(4-ethoxyphenyl)-7-{[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]sulfanyl}pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one
Compound characteristics
| Compound ID: | F835-0442 |
| Compound Name: | 2-(4-ethoxyphenyl)-7-{[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]sulfanyl}pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one |
| Molecular Weight: | 446.49 |
| Molecular Formula: | C22 H18 N6 O3 S |
| Smiles: | CCOc1ccc(cc1)c1cc2C(NN=C(n2n1)SCc1nc(c2ccccc2)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8994 |
| logD: | 4.8979 |
| logSw: | -4.5465 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.781 |
| InChI Key: | ZCRSWTLCUMFUJT-UHFFFAOYSA-N |