2-{[2-(3,4-dimethoxyphenyl)-4-oxo-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}-N-(4-fluorophenyl)-N-methylacetamide
Chemical Structure Depiction of
2-{[2-(3,4-dimethoxyphenyl)-4-oxo-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}-N-(4-fluorophenyl)-N-methylacetamide
2-{[2-(3,4-dimethoxyphenyl)-4-oxo-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}-N-(4-fluorophenyl)-N-methylacetamide
Compound characteristics
| Compound ID: | F424-1146 |
| Compound Name: | 2-{[2-(3,4-dimethoxyphenyl)-4-oxo-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}-N-(4-fluorophenyl)-N-methylacetamide |
| Molecular Weight: | 469.49 |
| Molecular Formula: | C22 H20 F N5 O4 S |
| Smiles: | CN(C(CSC1=NNC(c2cc(c3ccc(c(c3)OC)OC)nn12)=O)=O)c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 2.5796 |
| logD: | 2.5781 |
| logSw: | -3.0319 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.688 |
| InChI Key: | DSRSVXWDKAOSHD-UHFFFAOYSA-N |