methyl ({8-[4-(4-fluorophenyl)piperazine-1-sulfonyl][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)acetate
Chemical Structure Depiction of
methyl ({8-[4-(4-fluorophenyl)piperazine-1-sulfonyl][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)acetate
methyl ({8-[4-(4-fluorophenyl)piperazine-1-sulfonyl][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)acetate
Compound characteristics
| Compound ID: | M114-1437 |
| Compound Name: | methyl ({8-[4-(4-fluorophenyl)piperazine-1-sulfonyl][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)acetate |
| Molecular Weight: | 465.52 |
| Molecular Formula: | C19 H20 F N5 O4 S2 |
| Smiles: | COC(CSc1nnc2c(cccn12)S(N1CCN(CC1)c1ccc(cc1)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5445 |
| logD: | 1.5445 |
| logSw: | -2.1138 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 78.527 |
| InChI Key: | DZEKATRSPPFPOE-UHFFFAOYSA-N |