methyl {[2-(3,4-dimethoxyphenyl)-4-oxo-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetate
Chemical Structure Depiction of
methyl {[2-(3,4-dimethoxyphenyl)-4-oxo-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetate
methyl {[2-(3,4-dimethoxyphenyl)-4-oxo-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | F835-0372 |
| Compound Name: | methyl {[2-(3,4-dimethoxyphenyl)-4-oxo-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetate |
| Molecular Weight: | 376.39 |
| Molecular Formula: | C16 H16 N4 O5 S |
| Smiles: | COC(CSC1=NNC(c2cc(c3ccc(c(c3)OC)OC)nn12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6074 |
| logD: | 1.6059 |
| logSw: | -2.4256 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.426 |
| InChI Key: | LGQZEBYJCLZATF-UHFFFAOYSA-N |