tert-butyl N-(2H-1,3-benzodioxol-5-yl)-N-(3-methyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonyl)glycinate
Chemical Structure Depiction of
tert-butyl N-(2H-1,3-benzodioxol-5-yl)-N-(3-methyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonyl)glycinate
tert-butyl N-(2H-1,3-benzodioxol-5-yl)-N-(3-methyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonyl)glycinate
Compound characteristics
| Compound ID: | P048-1405 |
| Compound Name: | tert-butyl N-(2H-1,3-benzodioxol-5-yl)-N-(3-methyl[1,2,4]triazolo[4,3-a]pyridine-6-sulfonyl)glycinate |
| Molecular Weight: | 446.48 |
| Molecular Formula: | C20 H22 N4 O6 S |
| Smiles: | Cc1nnc2ccc(cn12)S(N(CC(=O)OC(C)(C)C)c1ccc2c(c1)OCO2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2514 |
| logD: | 2.2514 |
| logSw: | -2.8406 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 90.728 |
| InChI Key: | SSDQKSSLUVZXMN-UHFFFAOYSA-N |