ethyl ({8-[4-(4-fluorophenyl)piperazine-1-sulfonyl][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)acetate
Chemical Structure Depiction of
ethyl ({8-[4-(4-fluorophenyl)piperazine-1-sulfonyl][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)acetate
ethyl ({8-[4-(4-fluorophenyl)piperazine-1-sulfonyl][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)acetate
Compound characteristics
| Compound ID: | M114-1438 |
| Compound Name: | ethyl ({8-[4-(4-fluorophenyl)piperazine-1-sulfonyl][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)acetate |
| Molecular Weight: | 479.55 |
| Molecular Formula: | C20 H22 F N5 O4 S2 |
| Smiles: | CCOC(CSc1nnc2c(cccn12)S(N1CCN(CC1)c1ccc(cc1)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1356 |
| logD: | 2.1356 |
| logSw: | -2.3849 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 78.107 |
| InChI Key: | BWNGSLBKMANGKX-UHFFFAOYSA-N |