2-[(2H-1,3-benzodioxol-5-yl)methyl]-8-(piperidine-1-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-(piperidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
2-[(2H-1,3-benzodioxol-5-yl)methyl]-8-(piperidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Compound characteristics
| Compound ID: | M113-0175 |
| Compound Name: | 2-[(2H-1,3-benzodioxol-5-yl)methyl]-8-(piperidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one |
| Molecular Weight: | 416.45 |
| Molecular Formula: | C19 H20 N4 O5 S |
| Smiles: | C1CCN(CC1)S(C1=CC=CN2C1=NN(Cc1ccc3c(c1)OCO3)C2=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1179 |
| logD: | 2.1179 |
| logSw: | -2.8049 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.128 |
| InChI Key: | PTQPDQOHYAPGKD-UHFFFAOYSA-N |