2-[(2-methylphenyl)methyl]-6-(piperidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Chemical Structure Depiction of
2-[(2-methylphenyl)methyl]-6-(piperidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
2-[(2-methylphenyl)methyl]-6-(piperidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Compound characteristics
| Compound ID: | P047-0082 |
| Compound Name: | 2-[(2-methylphenyl)methyl]-6-(piperidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one |
| Molecular Weight: | 386.47 |
| Molecular Formula: | C19 H22 N4 O3 S |
| Smiles: | Cc1ccccc1CN1C(N2C=C(C=CC2=N1)S(N1CCCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9623 |
| logD: | 2.9622 |
| logSw: | -3.0846 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.51 |
| InChI Key: | IXNRJXUIZCTGER-UHFFFAOYSA-N |