N-(2H-1,3-benzodioxol-5-yl)-N-(cyanomethyl)-3-ethyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-N-(cyanomethyl)-3-ethyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
N-(2H-1,3-benzodioxol-5-yl)-N-(cyanomethyl)-3-ethyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Compound characteristics
| Compound ID: | P048-1429 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-N-(cyanomethyl)-3-ethyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide |
| Molecular Weight: | 385.4 |
| Molecular Formula: | C17 H15 N5 O4 S |
| Smiles: | CCc1nnc2ccc(cn12)S(N(CC#N)c1ccc2c(c1)OCO2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4296 |
| logD: | 1.4296 |
| logSw: | -2.3556 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 89.129 |
| InChI Key: | ABJWNEBZQMMOOM-UHFFFAOYSA-N |