2-[(2-methylphenyl)methyl]-6-(morpholine-4-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Chemical Structure Depiction of
2-[(2-methylphenyl)methyl]-6-(morpholine-4-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
2-[(2-methylphenyl)methyl]-6-(morpholine-4-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Compound characteristics
| Compound ID: | P047-0391 |
| Compound Name: | 2-[(2-methylphenyl)methyl]-6-(morpholine-4-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one |
| Molecular Weight: | 388.44 |
| Molecular Formula: | C18 H20 N4 O4 S |
| Smiles: | Cc1ccccc1CN1C(N2C=C(C=CC2=N1)S(N1CCOCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9728 |
| logD: | 1.9727 |
| logSw: | -2.3328 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.419 |
| InChI Key: | PDKLUIRBVNTBSZ-UHFFFAOYSA-N |