N-(cyanomethyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Chemical Structure Depiction of
N-(cyanomethyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
N-(cyanomethyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Compound characteristics
| Compound ID: | P048-1465 |
| Compound Name: | N-(cyanomethyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide |
| Molecular Weight: | 371.37 |
| Molecular Formula: | C16 H13 N5 O4 S |
| Smiles: | C(C#N)N(c1ccc2c(c1)OCCO2)S(c1ccc2nncn2c1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.0571 |
| logD: | 0.0571 |
| logSw: | -2.1392 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 88.303 |
| InChI Key: | FVKFMXATFFLNMA-UHFFFAOYSA-N |