3-{[(3-chlorophenyl)methyl]sulfanyl}-8-(pyrrolidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridine
Chemical Structure Depiction of
3-{[(3-chlorophenyl)methyl]sulfanyl}-8-(pyrrolidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridine
3-{[(3-chlorophenyl)methyl]sulfanyl}-8-(pyrrolidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridine
Compound characteristics
| Compound ID: | M114-0118 |
| Compound Name: | 3-{[(3-chlorophenyl)methyl]sulfanyl}-8-(pyrrolidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridine |
| Molecular Weight: | 408.93 |
| Molecular Formula: | C17 H17 Cl N4 O2 S2 |
| Smiles: | C1CCN(C1)S(c1cccn2c(nnc12)SCc1cccc(c1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9793 |
| logD: | 2.9793 |
| logSw: | -3.4136 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.782 |
| InChI Key: | INVNKHRHNVCQCU-UHFFFAOYSA-N |