2-(3,4-dimethoxyphenyl)-7-{[(3-methoxyphenyl)methyl]sulfanyl}pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one
Chemical Structure Depiction of
2-(3,4-dimethoxyphenyl)-7-{[(3-methoxyphenyl)methyl]sulfanyl}pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one
2-(3,4-dimethoxyphenyl)-7-{[(3-methoxyphenyl)methyl]sulfanyl}pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one
Compound characteristics
| Compound ID: | F835-0349 |
| Compound Name: | 2-(3,4-dimethoxyphenyl)-7-{[(3-methoxyphenyl)methyl]sulfanyl}pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one |
| Molecular Weight: | 424.48 |
| Molecular Formula: | C21 H20 N4 O4 S |
| Smiles: | COc1cccc(CSC2=NNC(c3cc(c4ccc(c(c4)OC)OC)nn23)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.6448 |
| logD: | 3.6437 |
| logSw: | -4.0084 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.119 |
| InChI Key: | BZKITJJNWCXLGY-UHFFFAOYSA-N |