N-(2H-1,3-benzodioxol-5-yl)-N-[(4-ethenylphenyl)methyl][1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-N-[(4-ethenylphenyl)methyl][1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
N-(2H-1,3-benzodioxol-5-yl)-N-[(4-ethenylphenyl)methyl][1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Compound characteristics
| Compound ID: | P048-1363 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-N-[(4-ethenylphenyl)methyl][1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide |
| Molecular Weight: | 434.47 |
| Molecular Formula: | C22 H18 N4 O4 S |
| Smiles: | C=Cc1ccc(CN(c2ccc3c(c2)OCO3)S(c2ccc3nncn3c2)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4829 |
| logD: | 3.4829 |
| logSw: | -3.6162 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.853 |
| InChI Key: | QGWFBGYCCWJCHR-UHFFFAOYSA-N |