methyl 5-({[8-(piperidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]sulfanyl}methyl)furan-2-carboxylate
Chemical Structure Depiction of
methyl 5-({[8-(piperidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]sulfanyl}methyl)furan-2-carboxylate
methyl 5-({[8-(piperidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]sulfanyl}methyl)furan-2-carboxylate
Compound characteristics
| Compound ID: | M114-0198 |
| Compound Name: | methyl 5-({[8-(piperidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]sulfanyl}methyl)furan-2-carboxylate |
| Molecular Weight: | 436.51 |
| Molecular Formula: | C18 H20 N4 O5 S2 |
| Smiles: | COC(c1ccc(CSc2nnc3c(cccn23)S(N2CCCCC2)(=O)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1118 |
| logD: | 2.1118 |
| logSw: | -2.3364 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 83.432 |
| InChI Key: | WZMWHFPKJKJNBN-UHFFFAOYSA-N |