N-(cyanomethyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methyl[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)-3-methyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
N-(cyanomethyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Compound characteristics
| Compound ID: | P048-1495 |
| Compound Name: | N-(cyanomethyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide |
| Molecular Weight: | 385.4 |
| Molecular Formula: | C17 H15 N5 O4 S |
| Smiles: | Cc1nnc2ccc(cn12)S(N(CC#N)c1ccc2c(c1)OCCO2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.0612 |
| logD: | -0.0612 |
| logSw: | -2.1222 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 87.637 |
| InChI Key: | GSICPJAYQVYRSB-UHFFFAOYSA-N |