N-(2H-1,3-benzodioxol-5-yl)-N-(cyanomethyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-N-(cyanomethyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
N-(2H-1,3-benzodioxol-5-yl)-N-(cyanomethyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Compound characteristics
| Compound ID: | P048-1355 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-N-(cyanomethyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide |
| Molecular Weight: | 357.35 |
| Molecular Formula: | C15 H11 N5 O4 S |
| Smiles: | C(C#N)N(c1ccc2c(c1)OCO2)S(c1ccc2nncn2c1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9177 |
| logD: | 0.9177 |
| logSw: | -2.1958 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 89.595 |
| InChI Key: | VXIVWVHEAJBXQU-UHFFFAOYSA-N |