2-[(2H-1,3-benzodioxol-5-yl)methyl]-8-(morpholine-4-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Chemical Structure Depiction of
2-[(2H-1,3-benzodioxol-5-yl)methyl]-8-(morpholine-4-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
2-[(2H-1,3-benzodioxol-5-yl)methyl]-8-(morpholine-4-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Compound characteristics
| Compound ID: | M113-0687 |
| Compound Name: | 2-[(2H-1,3-benzodioxol-5-yl)methyl]-8-(morpholine-4-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one |
| Molecular Weight: | 418.43 |
| Molecular Formula: | C18 H18 N4 O6 S |
| Smiles: | C1COCCN1S(C1=CC=CN2C1=NN(Cc1ccc3c(c1)OCO3)C2=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1285 |
| logD: | 1.1285 |
| logSw: | -2.451 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 88.036 |
| InChI Key: | LYOWGVNYRVYQPH-UHFFFAOYSA-N |