2-[(2H-1,3-benzodioxol-5-yl)methyl]-8-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl][1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Chemical Structure Depiction of
2-[(2H-1,3-benzodioxol-5-yl)methyl]-8-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl][1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
2-[(2H-1,3-benzodioxol-5-yl)methyl]-8-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl][1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Compound characteristics
| Compound ID: | M177-0572 |
| Compound Name: | 2-[(2H-1,3-benzodioxol-5-yl)methyl]-8-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl][1,2,4]triazolo[4,3-a]pyridin-3(2H)-one |
| Molecular Weight: | 427.42 |
| Molecular Formula: | C23 H17 N5 O4 |
| Smiles: | Cc1ccc(cc1)c1nc(C2=CC=CN3C2=NN(Cc2ccc4c(c2)OCO4)C3=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.4939 |
| logD: | 4.4938 |
| logSw: | -4.4146 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 79.823 |
| InChI Key: | WBKHFQJCGDETRT-UHFFFAOYSA-N |