N-{[8-(3-ethyl-1,2,4-oxadiazol-5-yl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}-3-(2-methoxyphenyl)prop-2-enamide
Chemical Structure Depiction of
N-{[8-(3-ethyl-1,2,4-oxadiazol-5-yl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}-3-(2-methoxyphenyl)prop-2-enamide
N-{[8-(3-ethyl-1,2,4-oxadiazol-5-yl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}-3-(2-methoxyphenyl)prop-2-enamide
Compound characteristics
| Compound ID: | S550-0102 |
| Compound Name: | N-{[8-(3-ethyl-1,2,4-oxadiazol-5-yl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}-3-(2-methoxyphenyl)prop-2-enamide |
| Molecular Weight: | 404.43 |
| Molecular Formula: | C21 H20 N6 O3 |
| Smiles: | CCc1nc(c2cccn3c(CNC(/C=C/c4ccccc4OC)=O)nnc23)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.4416 |
| logD: | 2.4416 |
| logSw: | -2.8351 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.869 |
| InChI Key: | PSDMLBHHKBMLRI-UHFFFAOYSA-N |